ChemSpider 2D Image | BORNYL FORMATE | C11H18O2

BORNYL FORMATE

  • Molecular FormulaC11H18O2
  • Average mass182.259 Da
  • Monoisotopic mass182.130676 Da
  • ChemSpider ID32700157

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1R,2S,4R)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl formate [ACD/IUPAC Name]
(1R,2S,4R)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-ylformiat [German] [ACD/IUPAC Name]
7492-41-3 [RN]
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, formate, (1R,2S,4R)- [ACD/Index Name]
BORNYL FORMATE
Formiate de (1R,2S,4R)-1,7,7-triméthylbicyclo[2.2.1]hept-2-yle [French] [ACD/IUPAC Name]
(1R,2S,4R)-Born-2-yl formate
74219-20-8 [RN]

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

L5W7JGM9QD [DBID]
UNII:L5W7JGM9QD [DBID]
UNII-L5W7JGM9QD [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 213.6±7.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.0±3.0 kJ/mol
Flash Point: 78.7±15.6 °C
Index of Refraction: 1.483
Molar Refractivity: 50.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 120.55
ACD/KOC (pH 5.5): 1074.77
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 120.55
ACD/KOC (pH 7.4): 1074.77
Polar Surface Area: 26 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 33.5±5.0 dyne/cm
Molar Volume: 178.5±5.0 cm3

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