ChemSpider 2D Image | 3-Methylbutyl (~2~H_3_)acetate | C7H11D3O2

3-Methylbutyl (2H3)acetate

  • Molecular FormulaC7H11D3O2
  • Average mass133.203 Da
  • Monoisotopic mass133.118210 Da
  • ChemSpider ID24533840

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H3)Acétate de 3-méthylbutyle [French] [ACD/IUPAC Name]
3-Methylbutyl (2H3)acetate [ACD/IUPAC Name]
3-Methylbutyl-(2H3)acetat [German] [ACD/IUPAC Name]
Acetic-d3 acid, 3-methylbutyl ester [ACD/Index Name]
1219804-75-7 [RN]
3-Methylbutyl Acetate-d3
Isopentyl Acetate, Isoamyl Acetate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 142.1±0.0 °C at 760 mmHg
Vapour Pressure: 5.7±0.2 mmHg at 25°C
Enthalpy of Vaporization: 37.9±3.0 kJ/mol
Flash Point: 25.0±0.0 °C
Index of Refraction: 1.404
Molar Refractivity: 36.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.12
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 18.99
ACD/KOC (pH 5.5): 286.31
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 18.99
ACD/KOC (pH 7.4): 286.31
Polar Surface Area: 26 Å2
Polarizability: 14.4±0.5 10-24cm3
Surface Tension: 25.6±3.0 dyne/cm
Molar Volume: 147.9±3.0 cm3

Click to predict properties on the Chemicalize site


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