ChemSpider 2D Image | 2,4,4-trimethylpent-2-enoic acid | C8H14O2

2,4,4-trimethylpent-2-enoic acid

  • Molecular FormulaC8H14O2
  • Average mass142.196 Da
  • Monoisotopic mass142.099380 Da
  • ChemSpider ID27017118

  • Double-bond stereo - Double-bond stereo

More details:

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

2,4,4-trimethylpent-2-enoic acid
99799-03-8 [RN]
(2E)-2,4,4-Trimethyl-2-pentenoic acid [ACD/IUPAC Name]
(2E)-2,4,4-Trimethyl-2-pentensäure [German] [ACD/IUPAC Name]
(2E)-2,4,4-trimethylpent-2-enoic acid
2-Pentenoic acid, 2,4,4-trimethyl-, (2E)- [ACD/Index Name]
2-Pentenoic acid, 2,4,4-trimethyl-, (E)-
60065-21-6 [RN]
Acide (2E)-2,4,4-triméthyl-2-penténoïque [French] [ACD/IUPAC Name]
CID 56997502
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 228.2±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 51.2±6.0 kJ/mol
Flash Point: 135.0±9.6 °C
Index of Refraction: 1.458
Molar Refractivity: 40.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.58
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 14.94
ACD/KOC (pH 5.5): 167.29
ACD/LogD (pH 7.4): 0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.00
Polar Surface Area: 37 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 31.0±3.0 dyne/cm
Molar Volume: 148.7±3.0 cm3

Click to predict properties on the Chemicalize site


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