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Search term: VHOGSWBAPDPWTG (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 3-(Methoxycarbonyl)-4-methylpentanoate | C8H13O4

3-(Methoxycarbonyl)-4-methylpentanoate

  • Molecular FormulaC8H13O4
  • Average mass173.187 Da
  • Monoisotopic mass173.081924 Da
  • ChemSpider ID95684946
  • Charge - Charge


More details:






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

3-(Methoxycarbonyl)-4-methylpentanoat [German] [ACD/IUPAC Name]
3-(Methoxycarbonyl)-4-methylpentanoate [ACD/IUPAC Name]
3-(Méthoxycarbonyl)-4-méthylpentanoate [French] [ACD/IUPAC Name]
Butanedioic acid, 2-(1-methylethyl)-, 1-methyl ester, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point: 272.4±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 56.2±6.0 kJ/mol
Flash Point: 104.3±16.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.02
ACD/LogD (pH 5.5): 0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.50
ACD/LogD (pH 7.4): -1.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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