ChemSpider 2D Image | 1-Amino-4-methyl-1H-imidazole-2-thiol | C4H7N3S

1-Amino-4-methyl-1H-imidazole-2-thiol

  • Molecular FormulaC4H7N3S
  • Average mass129.184 Da
  • Monoisotopic mass129.036072 Da
  • ChemSpider ID23499503

More details:

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

16163-48-7 [RN]
1-Amino-4-methyl-1H-imidazole-2-thiol
1-[4-(2-furanyl)phenyl]ethanone
1-[4-(2-Furyl)phenyl]ethanone [ACD/IUPAC Name]
1-Amino-4-methyl-1,3-dihydro-2H-imidazole-2-thione [ACD/IUPAC Name]
1-AMINO-4-METHYL-3H-IMIDAZOLE-2-THIONE
1-AMINO-4-METHYLIMIDAZOLE-2-THIOL
MFCD12755760

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

CCRIS 4693 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 308.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.0±3.0 kJ/mol
Flash Point: 140.6±25.9 °C
Index of Refraction: 1.711
Molar Refractivity: 34.5±0.5 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.90
ACD/LogD (pH 5.5): -2.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 83 Å2
Polarizability: 13.7±0.5 10-24cm3
Surface Tension: 51.6±7.0 dyne/cm
Molar Volume: 88.2±7.0 cm3

Click to predict properties on the Chemicalize site


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