ChemSpider 2D Image | (3R)-3,7-Dimethyl-6-octen-1-yl 2-aminobenzoate | C17H25NO2

(3R)-3,7-Dimethyl-6-octen-1-yl 2-aminobenzoate

  • Molecular FormulaC17H25NO2
  • Average mass275.386 Da
  • Monoisotopic mass275.188538 Da
  • ChemSpider ID34988846

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3,7-Dimethyl-6-octen-1-yl 2-aminobenzoate [ACD/IUPAC Name]
(3R)-3,7-Dimethyl-6-octen-1-yl-2-aminobenzoat [German] [ACD/IUPAC Name]
2-Aminobenzoate de (3R)-3,7-diméthyl-6-octén-1-yle [French] [ACD/IUPAC Name]
6-Octen-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (3R)- [ACD/Index Name]
271-433-2 [EINECS]
68555-57-7 [RN]
Citronellyl anthranilate
UNII-151μ54E8I

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

Density: 1.0±0.1 g/cm3
Boiling Point: 399.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 233.1±20.7 °C
Index of Refraction: 1.529
Molar Refractivity: 83.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.14
ACD/LogD (pH 5.5): 5.32
ACD/BCF (pH 5.5): 6453.77
ACD/KOC (pH 5.5): 18560.84
ACD/LogD (pH 7.4): 5.32
ACD/BCF (pH 7.4): 6456.78
ACD/KOC (pH 7.4): 18569.50
Polar Surface Area: 52 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 272.0±3.0 cm3

Click to predict properties on the Chemicalize site


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