Found 26 results

Search term: MF = 'C_{4}H_{6}N_{4}OS_{2}'
ChemSpider 2D Image | [(1-Methyl-1H-tetrazol-5-yl)sulfanyl]ethanethioic S-acid | C4H6N4OS2

[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]ethanethioic S-acid

  • Molecular FormulaC4H6N4OS2
  • Average mass190.247 Da
  • Monoisotopic mass189.998306 Da
  • ChemSpider ID28704507

More details:

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

[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]ethanethioic S-acid [ACD/IUPAC Name]
[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]ethanthio-S-säure [German] [ACD/IUPAC Name]
Ethanethioic acid, 2-[(1-methyl-1H-tetrazol-5-yl)thio]- [ACD/Index Name]
S-Acide de [(1-méthyl-1H-tétrazol-5-yl)sulfanyl]éthanethioïque [French] [ACD/IUPAC Name]
89753-93-5 [RN]
ETHANETHIOIC ACID, [(1-METHYL-1H-TETRAZOL-5-YL)THIO]-

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

Density: 1.7±0.1 g/cm3
Boiling Point: 408.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.7±3.0 kJ/mol
Flash Point: 201.0±31.5 °C
Index of Refraction: 1.780
Molar Refractivity: 47.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.09
ACD/LogD (pH 5.5): -1.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 18.8±0.5 10-24cm3
Surface Tension: 67.7±7.0 dyne/cm
Molar Volume: 112.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement