ChemSpider 2D Image | 2,2-Dimethyl-3-butynoyl chloride | C6H7ClO

2,2-Dimethyl-3-butynoyl chloride

  • Molecular FormulaC6H7ClO
  • Average mass130.572 Da
  • Monoisotopic mass130.018539 Da
  • ChemSpider ID34214449

More details:

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

2,2-Dimethyl-3-butinoylchlorid [German] [ACD/IUPAC Name]
2,2-Dimethyl-3-butynoyl chloride [ACD/IUPAC Name]
3-Butynoyl chloride, 2,2-dimethyl- [ACD/Index Name]
Chlorure de 2,2-diméthyl-3-butynoyle [French] [ACD/IUPAC Name]
114081-07-1 [RN]
2,2-dimethylbut-3-ynoyl chloride
MFCD25955799

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

Density: 1.1±0.1 g/cm3
Boiling Point: 132.3±23.0 °C at 760 mmHg
Vapour Pressure: 8.9±0.2 mmHg at 25°C
Enthalpy of Vaporization: 37.0±3.0 kJ/mol
Flash Point: 40.1±15.7 °C
Index of Refraction: 1.455
Molar Refractivity: 32.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 9.99
ACD/KOC (pH 5.5): 180.76
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 9.99
ACD/KOC (pH 7.4): 180.76
Polar Surface Area: 17 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 33.5±3.0 dyne/cm
Molar Volume: 119.9±3.0 cm3

Click to predict properties on the Chemicalize site


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