ChemSpider 2D Image | (2S,4R)-4-Methyl-5-oxotetrahydro-2-furancarbonyl chloride | C6H7ClO3

(2S,4R)-4-Methyl-5-oxotetrahydro-2-furancarbonyl chloride

  • Molecular FormulaC6H7ClO3
  • Average mass162.571 Da
  • Monoisotopic mass162.008377 Da
  • ChemSpider ID24187077

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,4R)-4-Methyl-5-oxotetrahydro-2-furancarbonyl chloride [ACD/IUPAC Name]
(2S,4R)-4-Methyl-5-oxotetrahydro-2-furancarbonylchlorid [German] [ACD/IUPAC Name]
Chlorure de (2S,4R)-4-méthyl-5-oxotétrahydro-2-furanecarbonyle [French] [ACD/IUPAC Name]
(2S,4R)-4-Methyl-5-oxooxolane-2-carbonyl chloride (non-preferred name)
2-Furancarbonyl chloride, tetrahydro-4-methyl-5-oxo-, (2S-trans)- (9CI)
88218-40-0 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 281.2±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.0±3.0 kJ/mol
Flash Point: 133.5±24.4 °C
Index of Refraction: 1.473
Molar Refractivity: 34.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.46
ACD/LogD (pH 5.5): -0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.31
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.31
Polar Surface Area: 43 Å2
Polarizability: 13.6±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 122.4±3.0 cm3

Click to predict properties on the Chemicalize site


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