Methylthiourea

C₂H₆N₂SCAS 598-52-790.14 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂H₆N₂S
Molar mass: 90.14 g/mol
Exact mass: 90.0252 Da
Melting point: 120 °C
logP: 0.07Crippen estimate
Polar surface area: 35.9 Å²
H-bond donors / acceptors: 3 / 1
Rotatable bonds: 0

Identifiers

CAS number

598-52-7

SMILES

CNC(=N)S

InChIKey

KQJQICVXLJTWQD-UHFFFAOYSA-N

InChI

InChI=1S/C2H6N2S/c1-4-2(3)5/h1H3,(H3,3,4,5)

Weigh it out

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

Names and synonyms

13 names · show all

Thiourea, N-methyl-
Urea, 1-methyl-2-thio-
Thiourea, methyl-
Pseudourea, 1-methyl-2-thio-
N-Methylthiourea
1-Methyl-2-thiourea
1-Methylthiourea
1-Methylthiocarbamide
Methylthiocarbamide
N-Methylthiocarbamide
Monomethylthiourea
N-Methyl-2-thiourea
NSC 30213

Reactions

METHYLTHIOUREA (Urea, 1-methyl-2-thio-)product

Work with Methylthiourea

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

Dithiourea142-46-150 % similar Dithiobiuret541-53-750 % similar N-(1-Methylethyl)thiourea1719-76-245 % similar Thiosemicarbazide hydrochloride4346-94-543 % similar Ethylthiourea625-53-643 % similar N-(1,1-Dimethylethyl)thiourea7204-48-043 % similar Thiosemicarbazide79-19-643 % similar Acetone thiosemicarbazone1752-30-340 % similar

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

Same formula

Methylisothiourea2986-19-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook