ChemSpider 2D Image | 4-Amino-3-chloro-2-pentenedioic acid | C5H6ClNO4

4-Amino-3-chloro-2-pentenedioic acid

  • Molecular FormulaC5H6ClNO4
  • Average mass179.558 Da
  • Monoisotopic mass178.998535 Da
  • ChemSpider ID23353563

More details:

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

2-Pentenedioic acid, 4-amino-3-chloro- [ACD/Index Name]
4-Amino-3-chlor-2-pentendisäure [German] [ACD/IUPAC Name]
4-Amino-3-chloro-2-pentenedioic acid [ACD/IUPAC Name]
Acide 4-amino-3-chloro-2-pentènedioïque [French] [ACD/IUPAC Name]
1562563-03-4 [RN]
90288-29-2 [RN]
MFCD24515817

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

Density: 1.6±0.1 g/cm3
Boiling Point: 421.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 74.1±6.0 kJ/mol
Flash Point: 208.6±28.7 °C
Index of Refraction: 1.585
Molar Refractivity: 36.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.63
ACD/LogD (pH 5.5): -3.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 14.5±0.5 10-24cm3
Surface Tension: 76.5±3.0 dyne/cm
Molar Volume: 109.2±3.0 cm3

Click to predict properties on the Chemicalize site


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