ChemSpider 2D Image | trans-dibutyl 4-cyclohexene-1,2-dicarboxylate | C16H26O4

trans-dibutyl 4-cyclohexene-1,2-dicarboxylate

  • Molecular FormulaC16H26O4
  • Average mass282.375 Da
  • Monoisotopic mass282.183105 Da
  • ChemSpider ID58828009

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,2R)-4-Cyclohexène-1,2-dicarboxylate de dibutyle [French] [ACD/IUPAC Name]
4-Cyclohexene-1,2-dicarboxylic acid, dibutyl ester, (1R,2R)- [ACD/Index Name]
64111-75-7 [RN]
Dibutyl (1R,2R)-4-cyclohexene-1,2-dicarboxylate [ACD/IUPAC Name]
Dibutyl-(1R,2R)-4-cyclohexen-1,2-dicarboxylat [German] [ACD/IUPAC Name]
trans-dibutyl 4-cyclohexene-1,2-dicarboxylate
DIBUTYL 4-CYCLOHEXENE-1,2-DICARBOXYLATE, TRANS-

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

70P04IFK5M [DBID]
UNII:70P04IFK5M [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: 358.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.4±3.0 kJ/mol
Flash Point: 168.5±26.3 °C
Index of Refraction: 1.474
Molar Refractivity: 77.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.53
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 826.20
ACD/KOC (pH 5.5): 4262.36
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 826.20
ACD/KOC (pH 7.4): 4262.36
Polar Surface Area: 53 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 274.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement