ChemSpider 2D Image | 1-Chloro-4-methoxy-2-butyne | C5H7ClO

1-Chloro-4-methoxy-2-butyne

  • Molecular FormulaC5H7ClO
  • Average mass118.562 Da
  • Monoisotopic mass118.018539 Da
  • ChemSpider ID32037596

More details:

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

1-Chlor-4-methoxy-2-butin [German] [ACD/IUPAC Name]
1-Chloro-4-methoxy-2-butyne [ACD/IUPAC Name]
1-Chloro-4-méthoxy-2-butyne [French] [ACD/IUPAC Name]
2-Butyne, 1-chloro-4-methoxy- [ACD/Index Name]
1-chloro-4-methoxybut-2-yne
693-27-6 [RN]
MFCD19232090

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

Density: 1.1±0.1 g/cm3
Boiling Point: 171.9±15.0 °C at 760 mmHg
Vapour Pressure: 1.8±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.2±3.0 kJ/mol
Flash Point: 65.3±14.4 °C
Index of Refraction: 1.445
Molar Refractivity: 29.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 1.46
ACD/BCF (pH 5.5): 7.59
ACD/KOC (pH 5.5): 148.57
ACD/LogD (pH 7.4): 1.46
ACD/BCF (pH 7.4): 7.59
ACD/KOC (pH 7.4): 148.57
Polar Surface Area: 9 Å2
Polarizability: 11.8±0.5 10-24cm3
Surface Tension: 32.3±3.0 dyne/cm
Molar Volume: 112.1±3.0 cm3

Click to predict properties on the Chemicalize site


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