ChemSpider 2D Image | 3-(2-Ethoxycarbonylethyl)phenylboronic acid | C11H15BO4

3-(2-Ethoxycarbonylethyl)phenylboronic acid

  • Molecular FormulaC11H15BO4
  • Average mass222.045 Da
  • Monoisotopic mass222.106339 Da
  • ChemSpider ID21474388

More details:

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

[3-(3-Ethoxy-3-oxopropyl)phenyl]boronic acid [ACD/IUPAC Name]
[3-(3-Ethoxy-3-oxopropyl)phenyl]borsäure [German] [ACD/IUPAC Name]
3-(2-Ethoxycarbonylethyl)phenylboronic acid
913835-82-2 [RN]
Acide [3-(3-éthoxy-3-oxopropyl)phényl]boronique [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 3-borono-, ethyl ester [ACD/Index Name]
(3-(3-Ethoxy-3-oxopropyl)phenyl)boronic acid
(3-(3-Ethoxy-3-oxopropyl)phenyl)boronicacid
[3-(3-Ethoxy-3-oxo-propyl)phenyl]boronic acid
[913835-82-2] [RN]
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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: 382.6±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.6±3.0 kJ/mol
Flash Point: 185.2±28.4 °C
Index of Refraction: 1.518
Molar Refractivity: 58.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 23.63
ACD/KOC (pH 5.5): 334.71
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 21.89
ACD/KOC (pH 7.4): 310.01
Polar Surface Area: 67 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 44.2±5.0 dyne/cm
Molar Volume: 192.3±5.0 cm3

Click to predict properties on the Chemicalize site


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