ChemSpider 2D Image | 3-(ethyl(methyl)carbamoyl)phenylboronic acid | C10H14BNO3

3-(ethyl(methyl)carbamoyl)phenylboronic acid

  • Molecular FormulaC10H14BNO3
  • Average mass207.034 Da
  • Monoisotopic mass207.106674 Da
  • ChemSpider ID21474315

More details:

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

(3-(Ethyl(methyl)carbamoyl)phenyl)boronic acid
{3-[Ethyl(methyl)carbamoyl]phenyl}boronic acid [ACD/IUPAC Name]
{3-[Ethyl(methyl)carbamoyl]phenyl}borsäure [German] [ACD/IUPAC Name]
3-(ethyl(methyl)carbamoyl)phenylboronic acid
871333-07-2 [RN]
Acide {3-[éthyl(méthyl)carbamoyl]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-[(ethylmethylamino)carbonyl]phenyl]- [ACD/Index Name]
MFCD08056369 [MDL number]
(3-(Ethyl(methyl)carbamoyl)phenyl)boronicacid
[3-[ethyl(methyl)carbamoyl]phenyl]boronic acid
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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: 1.2±0.1 g/cm3
Boiling Point: 428.9±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 213.2±29.3 °C
Index of Refraction: 1.546
Molar Refractivity: 55.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.34
ACD/LogD (pH 5.5): 0.82
ACD/BCF (pH 5.5): 2.45
ACD/KOC (pH 5.5): 66.02
ACD/LogD (pH 7.4): 0.66
ACD/BCF (pH 7.4): 1.72
ACD/KOC (pH 7.4): 46.37
Polar Surface Area: 61 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 47.1±5.0 dyne/cm
Molar Volume: 176.2±5.0 cm3

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