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Search term: QEOPAXDMQKLKCF (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-Bromotetrahydro-2H-pyran-4-carboxylic acid | C6H9BrO3

4-Bromotetrahydro-2H-pyran-4-carboxylic acid

  • Molecular FormulaC6H9BrO3
  • Average mass209.038 Da
  • Monoisotopic mass207.973495 Da
  • ChemSpider ID34212068

More details:

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

1803600-06-7 [RN]
2H-Pyran-4-carboxylic acid, 4-bromotetrahydro- [ACD/Index Name]
4-Bromotetrahydro-2H-pyran-4-carboxylic acid [ACD/IUPAC Name]
4-Bromtetrahydro-2H-pyran-4-carbonsäure [German] [ACD/IUPAC Name]
Acide 4-bromotétrahydro-2H-pyrane-4-carboxylique [French] [ACD/IUPAC Name]
4-bromooxane-4-carboxylic acid
MFCD26936104

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

Density: 1.7±0.1 g/cm3
Boiling Point: 306.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 60.1±6.0 kJ/mol
Flash Point: 139.0±27.9 °C
Index of Refraction: 1.540
Molar Refractivity: 38.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): -2.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 47 Å2
Polarizability: 15.2±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 122.5±3.0 cm3

Click to predict properties on the Chemicalize site


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