ChemSpider 2D Image | (+)-terpinene 4-acetate | C12H20O2

(+)-terpinene 4-acetate

  • Molecular FormulaC12H20O2
  • Average mass196.286 Da
  • Monoisotopic mass196.146332 Da
  • ChemSpider ID32698089

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(+)-terpinene 4-acetate
(±)-α-Terpinyl acetate
(1R)-1-Isopropyl-4-methyl-3-cyclohexen-1-yl acetate [ACD/IUPAC Name]
(1R)-1-Isopropyl-4-methyl-3-cyclohexen-1-yl-acetat [German] [ACD/IUPAC Name]
3-Cyclohexen-1-ol, 4-methyl-1-(1-methylethyl)-, acetate, (1R)- [ACD/Index Name]
Acétate de (1R)-1-isopropyl-4-méthyl-3-cyclohexén-1-yle [French] [ACD/IUPAC Name]
225-395-9 [EINECS]
232-357-5 [EINECS]
4821-04-9 [RN]
8007-35-0 [RN]
More...

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

6N2WP2RF7V [DBID]
UNII:6N2WP2RF7V [DBID]
UNII-6N2WP2RF7V [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: 236.3±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.3±3.0 kJ/mol
Flash Point: 87.9±11.8 °C
Index of Refraction: 1.467
Molar Refractivity: 57.1±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 3.86
ACD/BCF (pH 5.5): 505.72
ACD/KOC (pH 5.5): 2999.59
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 505.72
ACD/KOC (pH 7.4): 2999.59
Polar Surface Area: 26 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 30.8±5.0 dyne/cm
Molar Volume: 205.7±5.0 cm3

Click to predict properties on the Chemicalize site


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