ChemSpider 2D Image | (4-Methyl-1-naphthyl)methanethiol | C12H12S

(4-Methyl-1-naphthyl)methanethiol

  • Molecular FormulaC12H12S
  • Average mass188.289 Da
  • Monoisotopic mass188.065964 Da
  • ChemSpider ID37764253

More details:

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

(4-Methyl-1-naphthyl)methanethiol [ACD/IUPAC Name]
(4-Methyl-1-naphthyl)methanthiol [German] [ACD/IUPAC Name]
(4-Méthyl-1-naphtyl)méthanethiol [French] [ACD/IUPAC Name]
1-Naphthalenemethanethiol, 4-methyl- [ACD/Index Name]
4-Methyl-1-naphthalenemethanethiol
5261-52-9 [RN]
(4-methylnaphthalen-1-yl)methanethiol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 331.3±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.1±3.0 kJ/mol
Flash Point: 135.0±9.5 °C
Index of Refraction: 1.646
Molar Refractivity: 61.7±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 4.46
ACD/BCF (pH 5.5): 1433.19
ACD/KOC (pH 5.5): 6322.27
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1426.21
ACD/KOC (pH 7.4): 6291.50
Polar Surface Area: 39 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 170.2±3.0 cm3

Click to predict properties on the Chemicalize site


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