ChemSpider 2D Image | (S)-2-Chloro-1-(3,4-difluorophenyl)ethanol | C8H7ClF2O

(S)-2-Chloro-1-(3,4-difluorophenyl)ethanol

  • Molecular FormulaC8H7ClF2O
  • Average mass192.590 Da
  • Monoisotopic mass192.015350 Da
  • ChemSpider ID22836944

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1S)-2-Chlor-1-(3,4-difluorphenyl)ethanol [German] [ACD/IUPAC Name]
(1S)-2-Chloro-1-(3,4-difluorophenyl)ethan-1-ol [ACD/IUPAC Name]
(1S)-2-Chloro-1-(3,4-difluorophenyl)ethanol [ACD/IUPAC Name]
(1S)-2-Chloro-1-(3,4-difluorophényl)éthanol [French] [ACD/IUPAC Name]
(S)-2-Chloro-1-(3,4-difluorophenyl)ethanol [ACD/IUPAC Name]
(αS)-α-(Chloromethyl)-3,4-difluorobenzenemethanol
1006376-60-8 [RN]
15625158 [Beilstein]
Benzenemethanol, α-(chloromethyl)-3,4-difluoro-, (αS)- [ACD/Index Name]
G1YQR CF DF &&S Form [WLN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 256.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 52.2±3.0 kJ/mol
    Flash Point: 108.8±25.9 °C
    Index of Refraction: 1.513
    Molar Refractivity: 42.2±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.49
    ACD/LogD (pH 5.5): 1.74
    ACD/BCF (pH 5.5): 12.25
    ACD/KOC (pH 5.5): 209.21
    ACD/LogD (pH 7.4): 1.74
    ACD/BCF (pH 7.4): 12.25
    ACD/KOC (pH 7.4): 209.21
    Polar Surface Area: 20 Å2
    Polarizability: 16.7±0.5 10-24cm3
    Surface Tension: 39.6±3.0 dyne/cm
    Molar Volume: 140.3±3.0 cm3

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