ChemSpider 2D Image | 3-Chloro-5-(methylcarbamoyl)phenylboronic acid | C8H9BClNO3

3-Chloro-5-(methylcarbamoyl)phenylboronic acid

  • Molecular FormulaC8H9BClNO3
  • Average mass213.426 Da
  • Monoisotopic mass213.036407 Da
  • ChemSpider ID21472995

More details:

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

(3-Chloro-5-(methylcarbamoyl)phenyl)boronic acid
[3-Chlor-5-(methylcarbamoyl)phenyl]borsäure [German] [ACD/IUPAC Name]
[3-Chloro-5-(methylcarbamoyl)phenyl]boronic acid [ACD/IUPAC Name]
3-Chloro-5-(methylcarbamoyl)phenylboronic acid
957120-51-3 [RN]
Acide [3-chloro-5-(méthylcarbamoyl)phényl]boronique [French] [ACD/IUPAC Name]
B-[3-Chloro-5-[(methylamino)carbonyl]phenyl]boronic acid
Boronic acid, B-[3-chloro-5-[(methylamino)carbonyl]phenyl]- [ACD/Index Name]
(3-Chloro-5-(methylcarbamoyl)phenyl)boronicacid
[957120-51-3] [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.571
    Molar Refractivity: 51.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.08
    ACD/LogD (pH 5.5): 1.13
    ACD/BCF (pH 5.5): 4.24
    ACD/KOC (pH 5.5): 96.70
    ACD/LogD (pH 7.4): 0.48
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 21.50
    Polar Surface Area: 70 Å2
    Polarizability: 20.3±0.5 10-24cm3
    Surface Tension: 53.2±5.0 dyne/cm
    Molar Volume: 155.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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