ChemSpider 2D Image | TERT-BUTYL N-[(3S)-1-(2-CHLOROACETYL)PYRROLIDIN-3-YL]CARBAMATE | C11H19ClN2O3

TERT-BUTYL N-[(3S)-1-(2-CHLOROACETYL)PYRROLIDIN-3-YL]CARBAMATE

  • Molecular FormulaC11H19ClN2O3
  • Average mass262.733 Da
  • Monoisotopic mass262.108429 Da
  • ChemSpider ID28299288

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(3S)-1-(2-Chloroacétyl)-3-pyrrolidinyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1354015-96-5 [RN]
2-Methyl-2-propanyl [(3S)-1-(chloroacetyl)-3-pyrrolidinyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[(3S)-1-(chloracetyl)-3-pyrrolidinyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(3S)-1-(2-chloroacetyl)-3-pyrrolidinyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
TERT-BUTYL N-[(3S)-1-(2-CHLOROACETYL)PYRROLIDIN-3-YL]CARBAMATE
(S)-tert-Butyl (1-(2-chloroacetyl)pyrrolidin-3-yl)carbamate
[(S)-1-(2-Chloroacetyl)pyrrolidin-3-yl]carbamic acid tert-butyl ester
[(S)-1-(2-Chloro-acetyl)pyrrolidin-3-yl]-carbamic acid tert-butyl ester
[(S)-1-(2-Chloro-acetyl)-pyrrolidin-3-yl]-carbamic acid tert-butyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 407.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.0±3.0 kJ/mol
Flash Point: 200.4±28.7 °C
Index of Refraction: 1.508
Molar Refractivity: 65.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.96
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 4.88
ACD/KOC (pH 5.5): 108.28
ACD/LogD (pH 7.4): 1.21
ACD/BCF (pH 7.4): 4.88
ACD/KOC (pH 7.4): 108.27
Polar Surface Area: 59 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 42.7±5.0 dyne/cm
Molar Volume: 218.9±5.0 cm3

Click to predict properties on the Chemicalize site


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