ChemSpider 2D Image | N-[(3S)-1-(Chloroacetyl)-3-pyrrolidinyl]-N-isopropylacetamide | C11H19ClN2O2

N-[(3S)-1-(Chloroacetyl)-3-pyrrolidinyl]-N-isopropylacetamide

  • Molecular FormulaC11H19ClN2O2
  • Average mass246.734 Da
  • Monoisotopic mass246.113510 Da
  • ChemSpider ID28300720

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Acetamide, N-[(3S)-1-(2-chloroacetyl)-3-pyrrolidinyl]-N-(1-methylethyl)- [ACD/Index Name]
N-[(3S)-1-(2-Chloroacétyl)-3-pyrrolidinyl]-N-isopropylacétamide [French] [ACD/IUPAC Name]
N-[(3S)-1-(Chloracetyl)-3-pyrrolidinyl]-N-isopropylacetamid [German] [ACD/IUPAC Name]
N-[(3S)-1-(Chloroacetyl)-3-pyrrolidinyl]-N-isopropylacetamide [ACD/IUPAC Name]
(S)-N-(1-(2-Chloroacetyl)pyrrolidin-3-yl)-N-isopropylacetamide
1354010-31-3 [RN]
MFCD21096149
N-[(3S)-1-(2-CHLOROACETYL)PYRROLIDIN-3-YL]-N-(PROPAN-2-YL)ACETAMIDE
N-[(3S)-1-(2-CHLOROACETYL)PYRROLIDIN-3-YL]-N-ISOPROPYLACETAMIDE
N-[(S)-1-(2-Chloroacetyl)pyrrolidin-3-yl]-N-isopropylacetamide
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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: 399.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 195.5±27.9 °C
Index of Refraction: 1.514
Molar Refractivity: 63.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.32
ACD/LogD (pH 5.5): 0.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 33.60
ACD/LogD (pH 7.4): 0.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 33.60
Polar Surface Area: 41 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 42.0±5.0 dyne/cm
Molar Volume: 211.7±5.0 cm3

Click to predict properties on the Chemicalize site


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