chempirical

1-Methylhydrazinecarbothioamide

C2H7N3SCAS 6938-68-7105.16 g/mol

Open in Covalent MOL file
NH2NNHSH
Primary amineThiol

Properties

Molecular formula
C2H7N3S
Molar mass
105.16 g/mol
Exact mass
105.0361 Da
Melting point
183–184 °C
logP
-0.34Crippen estimate
Polar surface area
53.1 Ų
H-bond donors / acceptors
3 / 2
Rotatable bonds
0

Identifiers

CAS number
6938-68-7
SMILES
CN(N)C(=N)S
InChIKey
IIGQLQZSWDUOBI-UHFFFAOYSA-N
InChI
InChI=1S/C2H7N3S/c1-5(4)2(3)6/h4H2,1H3,(H2,3,6)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 2N-Methylthiosemicarbazide
  • 1-Amino-1-methylthiourea
  • Hydrazinecarbothioamide, 1-methyl-
  • Semicarbazide, 2-methyl-3-thio-
  • 2-Methyl-3-thiosemicarbazide
  • NSC 53998

Work with 1-Methylhydrazinecarbothioamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Methyl-N-phenylthiourea4104-75-035 % similar Thiourea62-56-630 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Methyl-3-thiosemicarbazide6610-29-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook