ChemSpider 2D Image | Methyl 2,5-difluoro-3-formylbenzoate | C9H6F2O3

Methyl 2,5-difluoro-3-formylbenzoate

  • Molecular FormulaC9H6F2O3
  • Average mass200.139 Da
  • Monoisotopic mass200.028503 Da
  • ChemSpider ID25949148

More details:

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

2,5-Difluoro-3-formylbenzoate de méthyle [French] [ACD/IUPAC Name]
952480-00-1 [RN]
Benzoic acid, 2,5-difluoro-3-formyl-, methyl ester [ACD/Index Name]
Methyl 2,5-difluoro-3-formylbenzoate [ACD/IUPAC Name]
Methyl-2,5-difluor-3-formylbenzoat [German] [ACD/IUPAC Name]
[952480-00-1] [RN]
BENZOICACID, 2,5-DIFLUORO-3-FORMYL-, METHYL ESTER
Methyl2,5-difluoro-3-formylbenzoate
MFCD11977397 [MDL number]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 293.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.3±3.0 kJ/mol
Flash Point: 127.4±22.2 °C
Index of Refraction: 1.519
Molar Refractivity: 44.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.27
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 19.36
ACD/KOC (pH 5.5): 290.27
ACD/LogD (pH 7.4): 2.00
ACD/BCF (pH 7.4): 19.36
ACD/KOC (pH 7.4): 290.27
Polar Surface Area: 43 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 40.3±3.0 dyne/cm
Molar Volume: 147.4±3.0 cm3

Click to predict properties on the Chemicalize site


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