589-82-2
Chemical Structure
3-Heptanol
- CAS 番号: 589-82-2
- Formula:C7H16O
- Molecular Weight:116.20
IUPAC Name: heptan-3-ol
InChIKey: RZKSECIXORKHQS-UHFFFAOYSA-N
SMILES: OC(CC)CCCC
Biological Activity: 3-Heptanol is a biotransformation product of n-heptane. 3-Heptanol can act as the building block in the synthesis of 4-(3-adamantan-1-yl-ureido)-butyric acid and cyclohexanecarboxylic acid derivatives as sEH inhibitors. 3-Heptanol can be used as a solvent to form microenvironments around single-walled carbon nanotubes. 3-Heptanol can be used in the preperation of substituted pyrimidine derivatives as C1 domain-targeted isophthalate analogs to study their binding affinities towards PKCα isoform[1][2][3][4].
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3-Heptanol | 3-Heptanol is a biotransformation product of n-heptane. 3-Heptanol can act as the building block in the synthesis of 4-(3-adamantan-1-yl-ureido)-butyric acid and cyclohexanecarboxylic acid derivatives as sEH inhibitors. 3-Heptanol can be used as a solvent to form microenvironments around single-walled carbon nanotubes. 3-Heptanol can be used in the preperation of substituted pyrimidine derivatives as C1 domain-targeted isophthalate analogs to study their binding affinities towards PKCα isoform. | |||||||||||||||||||||
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3-Heptanol-d4 | 3-Heptanol-d4 (Butylethylcarbinol-d4) is the deuterium labeled 3-Heptanol (HY-134058). 3-Heptanol is a biotransformation product of n-heptane. 3-Heptanol can act as the building block in the synthesis of 4-(3-adamantan-1-yl-ureido)-butyric acid and cyclohexanecarboxylic acid derivatives as sEH inhibitors. 3-Heptanol can be used as a solvent to form microenvironments around single-walled carbon nanotubes. 3-Heptanol can be used in the preperation of substituted pyrimidine derivatives as C1 domain-targeted isophthalate analogs to study their binding affinities towards PKCα isoform. | |||||||||||||||||||||
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References
- [1]. Perbellini L, et al., Identification of the n-heptane metabolites in rat and human urine. Arch Toxicol. 1986 Apr;58(4):229- [Content Brief]
- [2]. Kim IH, et al., Biologically active ester derivatives as potent inhibitors of the soluble epoxide hyhdrolase. Bioorg Med Chem Lett. 2012 Sep 15;22(18):5889-92. [Content Brief]
- [3]. Silvera-Batista CA, et al., Solvatochromic shifts of single-walled carbon nanotubes in nonpolar microenvironments. Phys Chem Chem Phys. 2010 Jul 14;12(26):6990-8. [Content Brief]
- [4]. Provenzani R, et al., Scaffold hopping from (5-hydroxymethyl) isophthalates to multisubstituted pyrimidines diminishes binding affinity to the C1 domain of protein kinase C. PLoS One. 2018 Apr 11;13(4):e0195668. [Content Brief]
