ChemSpider 2D Image | [1-(Methylsulfanyl)naphtho[2,1-b]furan-2-yl]acetic acid | C15H12O3S

[1-(Methylsulfanyl)naphtho[2,1-b]furan-2-yl]acetic acid

  • Molecular FormulaC15H12O3S
  • Average mass272.319 Da
  • Monoisotopic mass272.050720 Da
  • ChemSpider ID21119222

More details:

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

[1-(Methylsulfanyl)naphtho[2,1-b]furan-2-yl]acetic acid [ACD/IUPAC Name]
[1-(Methylsulfanyl)naphtho[2,1-b]furan-2-yl]essigsäure [German] [ACD/IUPAC Name]
Acide [1-(méthylsulfanyl)naphto[2,1-b]furan-2-yl]acétique [French] [ACD/IUPAC Name]
Naphtho[2,1-b]furan-2-acetic acid, 1-(methylthio)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 484.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.9±3.0 kJ/mol
Flash Point: 246.6±25.9 °C
Index of Refraction: 1.719
Molar Refractivity: 77.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.67
ACD/LogD (pH 5.5): 1.29
ACD/BCF (pH 5.5): 1.22
ACD/KOC (pH 5.5): 6.56
ACD/LogD (pH 7.4): 0.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 65.5±5.0 dyne/cm
Molar Volume: 197.4±5.0 cm3

Click to predict properties on the Chemicalize site


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