Cat. No.: HY-23155

2-Phenylethyl isothiocyanate

(Synonyms: 2-PE ITC)

1 Cited Publications

고객리뷰

Based on 1 publication(s) in Google Scholar

2-Phenylethyl isothiocyanate is a potent antifungal agent. 2-Phenylethyl isothiocyanate significantly inhibited spore germination and mycelial growth of Alternaria alternata, with a MIC (minimum inhibitory concentration) of 1.22 mM. The antifungal effect of 2-Phenylethyl isothiocyanate against Alternaria alternate might be via reduction in toxin content and breakdown of cell membrane integrity.

연구목적의 판매만을 진행합니다. 환자를 대상으로 한 판매는 하지 않습니다.

Purity: 98.00%
CAS No.: 2257-09-2
화학식: C₉H₉NS
분자량:163.24

보관:

Pure form -20°C, 3 years , 4°C, 2 years ; In solvent -80°C, 6 months , -20°C, 1 month

2-Phenylethyl isothiocyanate Chemical Structure

CAS No.: 2257-09-2

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Biological Activity
- 제품 설명
- Cellular Effect
- In Vitro
- In Vivo
Chemical Information
Publications (1)
용액&용해도
- In Vitro
- In Vivo
순도&문서
References
Help & FAQs
Classifications
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Biological Activity

제품 설명

Cellular Effect

Cell Line	Type	Value	Description	References
A549	IC₅₀	16.8 μM Compound: B	Antiproliferative activity against human A549 cells after 72 hrs by SRB assay Antiproliferative activity against human A549 cells after 72 hrs by SRB assay	[PMID: 21704523]
Caco-2	IC₅₀	14 μM Compound: 1b, PEITC	Cytotoxicity against human Caco-2 cells after 72 hrs by MTS assay Cytotoxicity against human Caco-2 cells after 72 hrs by MTS assay	[PMID: 19053750]
DLD-1	IC₅₀	54.59 μM Compound: 80	Anticancer activity against human DLD-1 cells assessed as reduction in cell viability Anticancer activity against human DLD-1 cells assessed as reduction in cell viability	[PMID: 33445154]
HT-1080	IC₅₀	15 μM Compound: 1b, PEITC	Cytotoxicity against human HT1080 cells after 72 hrs by MTS assay Cytotoxicity against human HT1080 cells after 72 hrs by MTS assay	[PMID: 19053750]
LoVo	IC₅₀	13.5 μM Compound: 27	Antiproliferative activity against human LoVo cells assessed as reduction in cell viability after 72 hrs by SRB assay Antiproliferative activity against human LoVo cells assessed as reduction in cell viability after 72 hrs by SRB assay	[PMID: 26639764]
LoVo	IC₅₀	13.5 μM Compound: B	Antiproliferative activity against human LoVo cells after 72 hrs by SRB assay Antiproliferative activity against human LoVo cells after 72 hrs by SRB assay	[PMID: 21704523]
LoVo	IC₅₀	9.8 μM Compound: B	Antiproliferative activity against doxorubicin-resistant human LoVo cells after 72 hrs by SRB assay Antiproliferative activity against doxorubicin-resistant human LoVo cells after 72 hrs by SRB assay	[PMID: 21704523]
LS174T	IC₅₀	7 μM Compound: 2	Antiproliferative activity against human LS 174T cells Antiproliferative activity against human LS 174T cells	[PMID: 18855447]
MCF7	IC₅₀	16.3 μM Compound: B	Antiproliferative activity against human MCF7 cells after 72 hrs by SRB assay Antiproliferative activity against human MCF7 cells after 72 hrs by SRB assay	[PMID: 21704523]
MCF7	IC₅₀	7.5 μM Compound: 1	Inhibition of Serine/threonine-protein kinase mTOR complex 1-mediated HIF1alpha RNA translation in human MCF7 cells pretreated for 1 hr prior to metabolic labeling by SDS-PAGE analysis Inhibition of Serine/threonine-protein kinase mTOR complex 1-mediated HIF1alpha RNA translation in human MCF7 cells pretreated for 1 hr prior to metabolic labeling by SDS-PAGE analysis	[PMID: 22607231]
MDA-MB-231	IC₅₀	38 μM Compound: 1b, PEITC	Cytotoxicity against human MDA-MB-231 cells after 72 hrs by MTS assay Cytotoxicity against human MDA-MB-231 cells after 72 hrs by MTS assay	[PMID: 19053750]
MEF	IC₅₀	4.7 μM Compound: 1	Inhibition of growth in wild type MEF cells after 6 days Inhibition of growth in wild type MEF cells after 6 days	[PMID: 22607231]
MEF	IC₅₀	8 μM Compound: 1	Inhibition of growth in TSC2-deficient MEF cells after 6 days Inhibition of growth in TSC2-deficient MEF cells after 6 days	[PMID: 22607231]
OVCAR-3	IC₅₀	23.2 μM Compound: 2	Antiproliferative activity against human OVCAR-3 cells Antiproliferative activity against human OVCAR-3 cells	[PMID: 18855447]
PC-3	IC₅₀	24 μM Compound: 1b, PEITC	Cytotoxicity against human PC-3 cells after 72 hrs by MTS assay Cytotoxicity against human PC-3 cells after 72 hrs by MTS assay	[PMID: 19053750]
SW480	IC₅₀	35.55 μM Compound: 80	Anticancer activity against human SW480 cells assessed as reduction in cell viability Anticancer activity against human SW480 cells assessed as reduction in cell viability	[PMID: 33445154]
T47D	IC₅₀	9.7 μM Compound: B	Antiproliferative activity against human T47D cells after 72 hrs by SRB assay Antiproliferative activity against human T47D cells after 72 hrs by SRB assay	[PMID: 21704523]
T98G	IC₅₀	>100 μM Compound: 1b, PEITC	Cytotoxicity against human T98G cells after 72 hrs by MTS assay Cytotoxicity against human T98G cells after 72 hrs by MTS assay	[PMID: 19053750]
UACC-903	IC₅₀	12 μM Compound: 1b, PEITC	Cytotoxicity against human UACC-903 cells after 72 hrs by MTS assay Cytotoxicity against human UACC-903 cells after 72 hrs by MTS assay	[PMID: 19053750]

In Vitro

2-Phenylethyl isothiocyanate (Compound 2-PE ITC) (0-5 mM) leads to a reduction in growth of various fungi and oomycetes^[1].
2-Phenylethyl isothiocyanate (0-4.88 mM, 0-6 d) shows dose-dependent inhibitory activity against A. alternate^[2].

MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.

In Vivo

2-Phenylethyl isothiocyanate (Compound 2-PEITC) (0-2.44 mM, 0-7 d) significantly controls black spot caused by A. alternate and damages membrane integrity of A. alternate in pear fruit^[2].

MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.

Chemical Information

CAS No. 2257-09-2

Appearance Liquid (Density: 1.094 g/cm³)

분자량 163.24

화학식 C₉H₉NS

Color Colorless to light yellow

SMILES

S=C=NCCC1=CC=CC=C1

Synonyms

2-PE ITC

선적

Room temperature in continental US; may vary elsewhere.

보관

Pure form -20°C 3 years

4°C 2 years

In solvent -80°C 6 months

-20°C 1 month

Publications (1)

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Most Recent

J Agric Food Chem

Transcription Repressor SsGATA2 Regulates Broad-Spectrum Resistance to Fungicides and Pathogenicity in Sclerotinia sclerotiorum. [Abstract]

2025 Jul 9;73(27):16787-16803. PMID: 40558024

용액&용해도

In Vitro:

DMSO : 100 mg/mL (612.59 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)

Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month. When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.

View the Complete Stock Solution Preparation Table

Preparing Stock Solutions

View the Complete Stock Solution Preparation Table

Concentration Solvent Mass

1 mg

5 mg

10 mg

Concentration

Solvent

Mass

1 mM

6.1259 mL

30.6297 mL

61.2595 mL

5 mM

1.2252 mL

6.1259 mL

12.2519 mL

10 mM

0.6126 mL

3.0630 mL

6.1259 mL

Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month. When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.

몰농도 계산기

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

Mass Mass

=
Concentration Concentration

×
Volume Volume

×
Molecular Weight Molecular Weight

농도 희석 계산기

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

Concentration _(start) Concentration _(start)

×

Volume _(start) Volume _(start)

=

Concentration _(final) Concentration _(final)

×

Volume _(final) Volume _(final)

In Vivo:

Select the appropriate dissolution method based on your experimental animal and administration route.

Stock Solution Working Solution

For the following dissolution methods, please ensure to first prepare a clear stock solution using an In Vitro approach and then sequentially add co-solvents:

To ensure reliable experimental results, the clarified stock solution can be appropriately stored based on storage conditions. As for the working solution for In Vivo experiments, it is recommended to prepare freshly and use it on the same day.

The percentages shown for the solvents indicate their volumetric ratio in the final prepared solution. If precipitation or phase separation occurs during preparation, heat and/or sonication can be used to aid dissolution.

Protocol 1

Add each solvent one by one: 10% DMSO 40% PEG300 5% Tween-80 45% Saline
Solubility: ≥ 2.5 mg/mL (15.31 mM); Clear solution

This protocol yields a clear solution of ≥ 2.5 mg/mL (saturation unknown).
Taking 1 mL working solution as an example, add 100 μL DMSO stock solution (25.0 mg/mL) to 400 μL PEG300, and mix evenly; then add 50 μL Tween-80 and mix evenly; then add 450 μL Saline to adjust the volume to 1 mL.
Preparation of Saline: Dissolve 0.9 g sodium chloride in ddH₂O and dilute to 100 mL to obtain a clear Saline solution.

Protocol 2

Add each solvent one by one: 10% DMSO 90% Corn Oil
Solubility: ≥ 2.5 mg/mL (15.31 mM); Clear solution

This protocol yields a clear solution of ≥ 2.5 mg/mL (saturation unknown). If the continuous dosing period exceeds half a month, please choose this protocol carefully.
Taking 1 mL working solution as an example, add 100 μL DMSO stock solution (25.0 mg/mL) to 900 μL Corn oil, and mix evenly.

In Vivo Dissolution Calculator

Please enter the basic information of animal experiments:

Dosage Dosage
mg/kg

Animal Weight (Per Animal) Animal Weight (Per Animal)
g

Dosing Volume (Per Animal) Dosing Volume (Per Animal)
μL

Number of Animals Number of Animals

Recommended: Prepare an additional quantity of animals to account for potential losses during experiments.

Recommended: Prepare an additional quantity of animals to account for potential losses during experiments.

Please enter your animal formula composition:

%
DMSO +

Recommended: Keep the proportion of DMSO in working solution below 2% if your animal is weak.

%
+

+
%
Tween-80 + +

%
Saline +

The co-solvents required include: DMSO, . All of co-solvents are available by MedChemExpress (MCE). , Tween 80. All of co-solvents are available by MedChemExpress (MCE).

Working solution concentration: 0.22 mg/mL

Method for preparing stock solution: mg drug dissolved in μL DMSO. Stock solution concentration: mg/mL.

The concentration of the stock solution you require exceeds the measured solubility. The following solution is for reference only. If necessary, please contact
MedChemExpress (MCE) .

Tel: 609-228-6898
E-mail: [email protected]
Technical Support: [email protected]

Method for preparing in vivo working solution for animal experiments:
1. Take μL DMSO stock solution;
2. Add μL .
μL , mix evenly;
3. Then add μL Tween 80, mix evenly;
4. Then add μL
Saline .

Dissolve 0.9 g sodium chloride in ddH₂O and dilute to 100 mL to obtain a clear Saline solution

If the continuous dosing period exceeds half a month, please choose this protocol carefully.

Please ensure that the stock solution in the first step is dissolved to a clear state, and add co-solvents in sequence. You can use ultrasonic heating (ultrasonic cleaner, recommended frequency 20-40 kHz), vortexing, etc. to assist dissolution.

순도&문서

Select Batch:

Purity: 99.98%

Assay: 99.98%

ee.: 99.98%

Data Sheet (270 KB)

SDS (618 KB)

English - EN (618 KB)

Français - FR (618 KB)

Deutsch - DE (618 KB)

Norwegian - NO (618 KB)

Español - ES (618 KB)

Swedish - SV (618 KB)

Italian - IT (618 KB)

Korean - KR (618 KB)

Portuguese - PT (618 KB)

COA (2659 KB)

Elemental Analysis Report (2659 KB)

HNMR (2659 KB)

CNMR (2659 KB)

RP-HPLC (2659 KB)

NP-HPLC (2659 KB)

MS (2659 KB)

LCMS (2659 KB)

IR (2659 KB)

GC (2659 KB)

OR (2659 KB)

SDS-PAGE (2659 KB)

SEC-HPLC (2659 KB)

Other Report (2659 KB)

Handling Instructions (2659 KB)

References

[1]. B. J. Smith, et al. In vitro inhibition of soil microorganisms by 2-phenylethyl isothiocyanate. Plant Pathology. 4 October 2002;51(5):585-593.

[2]. Zhang M, et al. 2-Phenylethyl Isothiocyanate Exerts Antifungal Activity against Alternaria alternata by Affecting Membrane Integrity and Mycotoxin Production. Toxins (Basel). 2020 Feb 15;12(2):124. [Content Brief]

Help & FAQs

How should lyophilized recombinant proteins be reconstituted and stored?

1. Before opening the cap, centrifuge the vial at 13000 rpm for 20-30 seconds. This step will ensure that any lyophilized powder that may have adhered to the cap or walls is collected at the bottom of the vial, minimizing the risk of product loss.

Complete Stock Solution Preparation Table

Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month. When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.

Optional Solvent Concentration Solvent Mass 1 mg 5 mg 10 mg 25 mg

DMSO 1 mM 6.1259 mL 30.6297 mL 61.2595 mL 153.1487 mL

5 mM 1.2252 mL 6.1259 mL 12.2519 mL 30.6297 mL

10 mM 0.6126 mL 3.0630 mL 6.1259 mL 15.3149 mL

15 mM 0.4084 mL 2.0420 mL 4.0840 mL 10.2099 mL

20 mM 0.3063 mL 1.5315 mL 3.0630 mL 7.6574 mL

25 mM 0.2450 mL 1.2252 mL 2.4504 mL 6.1259 mL

30 mM 0.2042 mL 1.0210 mL 2.0420 mL 5.1050 mL

40 mM 0.1531 mL 0.7657 mL 1.5315 mL 3.8287 mL

50 mM 0.1225 mL 0.6126 mL 1.2252 mL 3.0630 mL

60 mM 0.1021 mL 0.5105 mL 1.0210 mL 2.5525 mL

80 mM 0.0766 mL 0.3829 mL 0.7657 mL 1.9144 mL

100 mM 0.0613 mL 0.3063 mL 0.6126 mL 1.5315 mL

2-Phenylethyl isothiocyanate Related Classifications

HY-23155 Related Classifications

Anti-infection

Fungal

Disease Areas

Infection

Fungal Infection

Infection

Powered by Bioz See more details on Bioz

Keywords

2-Phenylethyl isothiocyanate
2257-09-2
2-PE ITC
Fungal
soil microorganisms
black spot
Alternaria alternate
antifungal
fungi
oomycetes
Inhibitor
inhibitor
inhibit

Your Recently Viewed Products

Pure form	-20°C	3 years
	4°C	2 years
In solvent	-80°C	6 months
	-20°C	1 month

Optional Solvent	Concentration Solvent Mass	1 mg	5 mg	10 mg	25 mg
DMSO	1 mM	6.1259 mL	30.6297 mL	61.2595 mL	153.1487 mL
5 mM	1.2252 mL	6.1259 mL	12.2519 mL	30.6297 mL
10 mM	0.6126 mL	3.0630 mL	6.1259 mL	15.3149 mL
15 mM	0.4084 mL	2.0420 mL	4.0840 mL	10.2099 mL
20 mM	0.3063 mL	1.5315 mL	3.0630 mL	7.6574 mL
25 mM	0.2450 mL	1.2252 mL	2.4504 mL	6.1259 mL
30 mM	0.2042 mL	1.0210 mL	2.0420 mL	5.1050 mL
40 mM	0.1531 mL	0.7657 mL	1.5315 mL	3.8287 mL
50 mM	0.1225 mL	0.6126 mL	1.2252 mL	3.0630 mL
60 mM	0.1021 mL	0.5105 mL	1.0210 mL	2.5525 mL
80 mM	0.0766 mL	0.3829 mL	0.7657 mL	1.9144 mL
100 mM	0.0613 mL	0.3063 mL	0.6126 mL	1.5315 mL

2-Phenylethyl isothiocyanate

1 Cited Publications

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2-Phenylethyl isothiocyanate

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Publications Citing Use of MedChemExpress (MCE) 2-Phenylethyl isothiocyanate

Biological Activity

Chemical Information

Publications (1)

용액&용해도

순도&문서

References

Help & FAQs

Complete Stock Solution Preparation Table