ChemSpider 2D Image | MFCD01927222 | C9H12BrNO2S

MFCD01927222

  • Molecular FormulaC9H12BrNO2S
  • Average mass278.166 Da
  • Monoisotopic mass276.977203 Da
  • ChemSpider ID21874872

More details:

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

(2-Bromo-3-thiényl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
21483-64-7 [RN]
2-Bromo-3-thiophenecarbamic acid (tert-butyl ester)
2-Methyl-2-propanyl (2-bromo-3-thienyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2-brom-3-thienyl)carbamat [German] [ACD/IUPAC Name]
3-(BOC-AMINO)-2-BROMOTHIOPHENE
Carbamic acid, N-(2-bromo-3-thienyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
MFCD01927222
N-(2-Bromo-3-thienyl)carbamic acid 1,1-dimethylethyl ester
N-Boc-3-amino-2-bromothiophene
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 276.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.5±3.0 kJ/mol
Flash Point: 121.0±23.2 °C
Index of Refraction: 1.591
Molar Refractivity: 62.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 3.28
ACD/BCF (pH 5.5): 181.93
ACD/KOC (pH 5.5): 1442.94
ACD/LogD (pH 7.4): 3.28
ACD/BCF (pH 7.4): 181.93
ACD/KOC (pH 7.4): 1442.94
Polar Surface Area: 67 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 45.7±3.0 dyne/cm
Molar Volume: 184.1±3.0 cm3

Click to predict properties on the Chemicalize site


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