ChemSpider 2D Image | (2Z,4Z)-2-Amino-5-chloro-2,4-hexadienedioic acid | C6H6ClNO4

(2Z,4Z)-2-Amino-5-chloro-2,4-hexadienedioic acid

  • Molecular FormulaC6H6ClNO4
  • Average mass191.569 Da
  • Monoisotopic mass190.998535 Da
  • ChemSpider ID28571918

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z,4Z)-2-Amino-5-chlor-2,4-hexadiendisäure [German] [ACD/IUPAC Name]
(2Z,4Z)-2-Amino-5-chloro-2,4-hexadienedioic acid [ACD/IUPAC Name]
2,4-Hexadienedioic acid, 2-amino-5-chloro-, (2Z,4Z)- [ACD/Index Name]
Acide (2Z,4Z)-2-amino-5-chloro-2,4-hexadiènedioïque [French] [ACD/IUPAC Name]
2,4-HEXADIENEDIOIC ACID, 2-AMINO-5-CHLORO- [ACD/Index Name]
887928-49-6 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 321.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 62.0±6.0 kJ/mol
Flash Point: 148.4±27.9 °C
Index of Refraction: 1.610
Molar Refractivity: 41.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.77
ACD/LogD (pH 5.5): -3.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 16.3±0.5 10-24cm3
Surface Tension: 74.4±3.0 dyne/cm
Molar Volume: 118.7±3.0 cm3

Click to predict properties on the Chemicalize site


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