ChemSpider 2D Image | (2S,4E)-2-Amino-5-chloro-4-pentenoic acid | C5H8ClNO2

(2S,4E)-2-Amino-5-chloro-4-pentenoic acid

  • Molecular FormulaC5H8ClNO2
  • Average mass149.576 Da
  • Monoisotopic mass149.024353 Da
  • ChemSpider ID50099555

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S,4E)-2-Amino-5-chlor-4-pentensäure [German] [ACD/IUPAC Name]
(2S,4E)-2-Amino-5-chloro-4-pentenoic acid [ACD/IUPAC Name]
4-Pentenoic acid, 2-amino-5-chloro-, (2S,4E)- [ACD/Index Name]
Acide (2S,4E)-2-amino-5-chloro-4-penténoïque [French] [ACD/IUPAC Name]
2089503-66-0 [RN]
MFCD19212420

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 275.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 56.6±6.0 kJ/mol
Flash Point: 120.6±27.3 °C
Index of Refraction: 1.525
Molar Refractivity: 35.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.99
ACD/LogD (pH 5.5): -1.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 13.9±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 114.7±3.0 cm3

Click to predict properties on the Chemicalize site


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