ChemSpider 2D Image | 4-(trans-4-hydroxycyclohexylcarbamoyl)phenylboronic acid | C13H18BNO4

4-(trans-4-hydroxycyclohexylcarbamoyl)phenylboronic acid

  • Molecular FormulaC13H18BNO4
  • Average mass263.097 Da
  • Monoisotopic mass263.132904 Da
  • ChemSpider ID28294067

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4-(((1r,4r)-4-Hydroxycyclohexyl)carbamoyl)phenyl)boronic acid
{4-[(trans-4-Hydroxycyclohexyl)carbamoyl]phenyl}borsäure [German] [ACD/IUPAC Name]
4-(trans-4-hydroxycyclohexylcarbamoyl)phenylboronic acid
957062-70-3 [RN]
Acide {4-[(trans-4-hydroxycyclohexyl)carbamoyl]phényl}boronique [French] [ACD/IUPAC Name]
MFCD09878333 [MDL number]
(4-((trans-4-Hydroxycyclohexyl)carbamoyl)phenyl)boronic acid
[957062-70-3] [RN]
{4-[(trans-4-Hydroxycyclohexyl)carbamoyl]phenyl}boronic acid [ACD/IUPAC Name]
1801290-26-5 [RN]
More...

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.583
Molar Refractivity: 68.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.58
ACD/LogD (pH 5.5): 0.77
ACD/BCF (pH 5.5): 2.26
ACD/KOC (pH 5.5): 62.36
ACD/LogD (pH 7.4): 0.70
ACD/BCF (pH 7.4): 1.94
ACD/KOC (pH 7.4): 53.43
Polar Surface Area: 90 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 57.3±5.0 dyne/cm
Molar Volume: 206.2±5.0 cm3

Click to predict properties on the Chemicalize site


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