chempirical

N-Propylthiourea

C4H10N2SCAS 927-67-3118.20 g/mol

Open in Covalent MOL file
NHNHSH
Thiol

Properties

Molecular formula
C4H10N2S
Molar mass
118.20 g/mol
Exact mass
118.0565 Da
Melting point
109 °C
logP
0.85Crippen estimate
Polar surface area
35.9 Ų
H-bond donors / acceptors
3 / 1
Rotatable bonds
2

Identifiers

CAS number
927-67-3
SMILES
CCCNC(=N)S
InChIKey
UHGKYJXJYJWDAM-UHFFFAOYSA-N
InChI
InChI=1S/C4H10N2S/c1-2-3-6-4(5)7/h2-3H2,1H3,(H3,5,6,7)

Weigh it out

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

Names and synonyms

5 names
  • Thiourea, N-propyl-
  • Urea, 1-propyl-2-thio-
  • Thiourea, propyl-
  • Propylthiourea
  • 1-Propyl-2-thiourea

Work with N-Propylthiourea

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-Butylthiourea1516-32-175 % similar Ethylthiourea625-53-658 % similar Propylurea627-06-550 % similar Allylthiourea109-57-941 % similar Methylthiourea598-52-740 % similar Dithiourea142-46-139 % similar Dithiobiuret541-53-739 % similar Butylurea592-31-438 % similar

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

Same formula

N-(1-Methylethyl)thiourea1719-76-2 Trimethylthiourea2489-77-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook