1-Phenyl-1-propanol

FT-IR spectroscopic analysis of 1-phenyl-1-propanol (4000-400 cm^-1) confirms that O-H vibrations are unaffected by other functional groups, while C-H out-of-plane and C=C stretching vibrations are influenced by the substitutional group^[2].
FT-Raman spectroscopic analysis of 1-phenyl-1-propanol (4000-100 cm^-1) confirms the vibrational assignments, with O-H vibrations unaffected by other groups and C-H and C=C vibrations influenced by the substitutional group^[2].
The HOMO-LUMO analysis of 1-phenyl-1-propanol indicates that the compound is chemically stable with a high chemical hardness of 3.16 eV and moderate electrophilicity index, and the molecule has strong intermolecular interactions due to its dipole moment^[2].
The Fukui function analysis of 1-phenyl-1-propanol identifies C4 and C2 as the preferred sites for nucleophilic attack and C1, C3, C5, C6 for electrophilic attack, with C6 showing anomalous nucleophilic behavior due to the O-H group^[2].
The MEP map of 1-phenyl-1-propanol shows that the oxygen atom is the most negative region (nucleophilic), while the phenyl ring and O-H hydrogen are electrophilic regions, indicating the molecule's reactive sites^[2].

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