chempirical

N-(2-Fluorophenyl)thiourea

C7H7FN2SCAS 656-32-6170.21 g/mol

Open in Covalent MOL file
NHHSHNF
Aryl halideThiol

Properties

Molecular formula
C7H7FN2S
Molar mass
170.21 g/mol
Exact mass
170.0314 Da
Boiling point
139–140 °C
logP
2.10Crippen estimate
Polar surface area
35.9 Ų
H-bond donors / acceptors
3 / 1
Rotatable bonds
1

Identifiers

CAS number
656-32-6
SMILES
N=C(S)Nc1ccccc1F
InChIKey
WYVZQQOFMQRNPF-UHFFFAOYSA-N
InChI
InChI=1S/C7H7FN2S/c8-5-3-1-2-4-6(5)10-7(9)11/h1-4H,(H3,9,10,11)

Weigh it out

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

Names and synonyms

6 names
  • Thiourea, N-(2-fluorophenyl)-
  • Urea, 1-(o-fluorophenyl)-2-thio-
  • Thiourea, (2-fluorophenyl)-
  • (2-Fluorophenyl)thiourea
  • 1-(2-Fluorophenyl)thiourea
  • 1-(2-Fluorophenyl)-2-thiourea

Work with N-(2-Fluorophenyl)thiourea

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-(2,4-Difluorophenyl)thiourea175277-76-662 % similar (2-Chlorophenyl)thiourea5344-82-158 % similar O-Tolylthiourea614-78-858 % similar N-[2-(Trifluoromethyl)phenyl]thiourea1736-71-657 % similar Alpha-naphthylthiourea86-88-456 % similar (2-Methoxyphenyl)thiourea1516-37-653 % similar Phenylthiocarbamide103-85-552 % similar (2-Fluorophenyl)hydrazine2368-80-145 % similar

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

Same formula

N-(4-Fluorophenyl)thiourea459-05-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook