ChemSpider 2D Image | ISOAMYL 4-(2-FURAN)BUTYRATE | C13H20O3

ISOAMYL 4-(2-FURAN)BUTYRATE

  • Molecular FormulaC13H20O3
  • Average mass224.296 Da
  • Monoisotopic mass224.141251 Da
  • ChemSpider ID30777203

More details:

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

2-Furanbutanoic acid, 3-methylbutyl ester [ACD/Index Name]
3-Methylbutyl 2-furanbutanoate
3-Methylbutyl 4-(2-furyl)butanoate [ACD/IUPAC Name]
3-Methylbutyl-4-(2-furyl)butanoat [German] [ACD/IUPAC Name]
4-(2-Furyl)butanoate de 3-méthylbutyle [French] [ACD/IUPAC Name]
7779-66-0 [RN]
ISOAMYL 4-(2-FURAN)BUTYRATE
3-methylbutyl 4-(furan-2-yl)butanoate
FEMA 2070
Isoamyl 2-furylbutyrate

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

37NU54C63L [DBID]
UNII:37NU54C63L [DBID]
UNII-37NU54C63L [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: 295.5±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.5±3.0 kJ/mol
Flash Point: 126.7±9.3 °C
Index of Refraction: 1.467
Molar Refractivity: 62.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.87
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 443.21
ACD/KOC (pH 5.5): 2729.29
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 443.21
ACD/KOC (pH 7.4): 2729.29
Polar Surface Area: 39 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 33.1±3.0 dyne/cm
Molar Volume: 224.5±3.0 cm3

Click to predict properties on the Chemicalize site


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