ChemSpider 2D Image | Methyl amino(thioxo)acetate | C3H5NO2S

Methyl amino(thioxo)acetate

  • Molecular FormulaC3H5NO2S
  • Average mass119.142 Da
  • Monoisotopic mass119.004097 Da
  • ChemSpider ID28544461

More details:






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

86563-22-6 [RN]
Acetic acid, 2-amino-2-thioxo-, methyl ester [ACD/Index Name]
Amino(thioxo)acétate de méthyle [French] [ACD/IUPAC Name]
Methyl amino(thioxo)acetate [ACD/IUPAC Name]
Methyl-amino(thioxo)acetat [German] [ACD/IUPAC Name]
Acetic acid,aminothioxo-,methyl ester (9CI)
ACETIC ACID,AMINOTHIOXO-,METHYL ESTER
Methyl amino(sulfanylidene)acetate
methyl carbamothioylformate
methyl thiocarbamoylformate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 181.3±23.0 °C at 760 mmHg
Vapour Pressure: 0.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.8±3.0 kJ/mol
Flash Point: 63.5±22.6 °C
Index of Refraction: 1.546
Molar Refractivity: 28.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.39
ACD/LogD (pH 5.5): -0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.53
ACD/LogD (pH 7.4): -0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.52
Polar Surface Area: 84 Å2
Polarizability: 11.3±0.5 10-24cm3
Surface Tension: 60.7±3.0 dyne/cm
Molar Volume: 90.2±3.0 cm3

Click to predict properties on the Chemicalize site






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