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Home> Encyclopedia > Hot Product Listed 1   > 1H-Tetrazole-5(4H)-thione
18686-81-2 structure

1H-Tetrazole-5(4H)-thione

Iupac Name:5H-tetrazole-5-thiol
CAS No.:18686-81-2
Molecular Weight:102.115
Molecular Formula:CH2N4S (isomer)
Names and Identifiers
Synonyms

1,2-Dihydro-5H-tetrazole-5-thione 1H-Tetrazole-5(4H)-thione 1H-Tetrazole-5-thiol

Inchi
InChI=1S/CH2N4S/c6-1-2-4-5-3-1/h1,6H
InChkey
AITMSAKVDTXWBP-UHFFFAOYSA-N
Canonical Smiles
C1(N=NN=N1)S
Properties
Density
2.17
Boiling Point
135.7°Cat760mmHg
Refractive Index
2.041
Flash Point
35.9°C
Solubility
SOL IN ISOPROPYL ALCOHOL
Color/Form
Clear, colorless liquid
Other physical and chemical properties
ACRYLONITRILE;, STABILIZED is a clear colorless liquid with a strong pungent odor. Flash point 32°F. Prolonged exposure to the vapors or skin contact harmful. Density 6.7 lb / gal. Vapors heavier than air. Combustion produces toxic oxides of nitrogen. Requires storage and handling in closed systems. Used in insecticides and to make plastics, fibers and other chemicals. Rate of onset: Immediate Persistence: Minutes to hours Odor threshold: 17 ppm Source/use/other hazard: Plastics, coatings, adhesives industries; dyes; pharmaceuticals; flam gas.
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:102.115g/mol
  • Molecular Formula:CH2N4S
  • Compound Is Canonicalized:True
  • Exact Mass:102
  • Monoisotopic Mass:102
  • Complexity:83.7
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Heavy Atom Count:6
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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