ChemSpider 2D Image | 2-(Propyl-2,2-d2)pentanoic-4,4-d2 Acid | C8H12D4O2

2-(Propyl-2,2-d2)pentanoic-4,4-d2 Acid

  • Molecular FormulaC8H12D4O2
  • Average mass148.236 Da
  • Monoisotopic mass148.140137 Da
  • ChemSpider ID24532912

  • Non-standard isotope - Non-standard isotope

More details:

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

2-(Propyl-2,2-d2)pentanoic-4,4-d2 Acid
2-[(2,2-2H2)Propyl](4,4-2H2)pentanoic acid [ACD/IUPAC Name]
2-[(2,2-2H2)Propyl](4,4-2H2)pentansäure [German] [ACD/IUPAC Name]
345909-03-7 [RN]
Acide 2-[(2,2-2H2)propyl](4,4-2H2)pentanoïque [French] [ACD/IUPAC Name]
Pentanoic-4,4-d2 acid, 2-(propyl-2,2-d2)- [ACD/Index Name]
2-Propylvaleric Acid
dipropylacetic acid
Valproic acid [BAN] [INN] [USAN] [USP] [Wiki]
VALPROIC ACID (4,4,4',4'-D4, 98%)

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

Density: 0.9±0.1 g/cm3
Boiling Point: 220.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 50.3±6.0 kJ/mol
Flash Point: 111.1±0.0 °C
Index of Refraction: 1.435
Molar Refractivity: 40.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 10.52
ACD/KOC (pH 5.5): 113.71
ACD/LogD (pH 7.4): 0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.84
Polar Surface Area: 37 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 31.8±3.0 dyne/cm
Molar Volume: 155.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement