ChemSpider 2D Image | 6-Amino-4,4,5,7,8-pentamethyl-3,4,4a,5-tetrahydro-2H-chromen-2-one | C14H21NO2

6-Amino-4,4,5,7,8-pentamethyl-3,4,4a,5-tetrahydro-2H-chromen-2-one

  • Molecular FormulaC14H21NO2
  • Average mass235.322 Da
  • Monoisotopic mass235.157227 Da
  • ChemSpider ID28689443

More details:

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

2H-1-Benzopyran-2-one, 6-amino-3,4,4a,5-tetrahydro-4,4,5,7,8-pentamethyl- [ACD/Index Name]
6-Amino-4,4,5,7,8-pentamethyl-3,4,4a,5-tetrahydro-2H-chromen-2-on [German] [ACD/IUPAC Name]
6-Amino-4,4,5,7,8-pentamethyl-3,4,4a,5-tetrahydro-2H-chromen-2-one [ACD/IUPAC Name]
6-Amino-4,4,5,7,8-pentaméthyl-3,4,4a,5-tétrahydro-2H-chromén-2-one [French] [ACD/IUPAC Name]
120372-42-1 [RN]
6-Amino-4,4,5,7,8-pentamethyldihydrocoumarin

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

Density: 1.1±0.1 g/cm3
Boiling Point: 351.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.6±3.0 kJ/mol
Flash Point: 196.2±25.4 °C
Index of Refraction: 1.532
Molar Refractivity: 67.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 13.95
ACD/KOC (pH 5.5): 141.05
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 73.07
ACD/KOC (pH 7.4): 738.76
Polar Surface Area: 52 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 38.3±5.0 dyne/cm
Molar Volume: 216.8±5.0 cm3

Click to predict properties on the Chemicalize site


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