ChemSpider 2D Image | 1-Chloro-1,3-butadiene | C4H5Cl

1-Chloro-1,3-butadiene

  • Molecular FormulaC4H5Cl
  • Average mass88.535 Da
  • Monoisotopic mass88.007980 Da
  • ChemSpider ID23351719

More details:






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

1,3-Butadiene, 1-chloro- [ACD/Index Name]
1-Chlor-1,3-butadien [German] [ACD/IUPAC Name]
1-Chloro-1,3-butadiene [ACD/IUPAC Name]
1-Chloro-1,3-butadiène [French] [ACD/IUPAC Name]
1-Chlorobuta-1,3-diene
627-22-5 [RN]
204-818-0 [EINECS]
50855-96-4 [RN]
CHLOROBUTADIENE [Wiki]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 68.0±0.0 °C at 760 mmHg
Vapour Pressure: 154.1±0.1 mmHg at 25°C
Enthalpy of Vaporization: 29.7±3.0 kJ/mol
Flash Point: -4.8±14.1 °C
Index of Refraction: 1.445
Molar Refractivity: 25.2±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 17.27
ACD/KOC (pH 5.5): 267.48
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 17.27
ACD/KOC (pH 7.4): 267.48
Polar Surface Area: 0 Å2
Polarizability: 10.0±0.5 10-24cm3
Surface Tension: 22.4±3.0 dyne/cm
Molar Volume: 94.7±3.0 cm3

Click to predict properties on the Chemicalize site






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