ChemSpider 2D Image | N-[(5-Methyl-1,2-oxazol-3-yl)carbamothioyl]benzamide | C12H11N3O2S

N-[(5-Methyl-1,2-oxazol-3-yl)carbamothioyl]benzamide

  • Molecular FormulaC12H11N3O2S
  • Average mass261.300 Da
  • Monoisotopic mass261.057190 Da
  • ChemSpider ID21474259

More details:

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

Benzamide, N-[[(5-methyl-3-isoxazolyl)amino]thioxomethyl]- [ACD/Index Name]
N-[(5-Methyl-1,2-oxazol-3-yl)carbamothioyl]benzamid [German] [ACD/IUPAC Name]
N-[(5-Methyl-1,2-oxazol-3-yl)carbamothioyl]benzamide [ACD/IUPAC Name]
N-[(5-Méthyl-1,2-oxazol-3-yl)carbamothioyl]benzamide [French] [ACD/IUPAC Name]
1-benzoyl-3-(5-methyl-1,2-oxazol-3-yl)thiourea
1-Benzoyl-3-(5-methylisoxazol-3-yl)thiourea
1-Benzoyl-3-(5-methylisoxazol-3-yl)thiourea, 3-[(Benzoylcarbamothioyl)amino]-5-methylisoxazole
1-Benzoyl-3-(5-methylisoxazol-3-yl)thiourea; 3-[(Benzoylcarbamothioyl)amino]-5-methylisoxazole
1-Benzoyl-3-(5-methylisoxazole)thiourea
3-[(Benzoylcarbamothioyl)amino]-5-methylisoxazole
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.673
Molar Refractivity: 71.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.14
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 9.91
ACD/KOC (pH 5.5): 179.53
ACD/LogD (pH 7.4): 1.53
ACD/BCF (pH 7.4): 8.11
ACD/KOC (pH 7.4): 147.06
Polar Surface Area: 99 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 67.4±3.0 dyne/cm
Molar Volume: 190.9±3.0 cm3

Click to predict properties on the Chemicalize site


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