chempirical

Alpha-naphthylthiourea

C11H10N2SCAS 86-88-4202.27 g/mol

Open in Covalent MOL file
NHHSHN
Thiol

Properties

Molecular formula
C11H10N2S
Molar mass
202.27 g/mol
Exact mass
202.0565 Da
Density
1 g/mL
Melting point
198 °C
logP
3.12Crippen estimate
Polar surface area
35.9 Ų
H-bond donors / acceptors
3 / 1
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
86-88-4
SMILES
N=C(S)Nc1cccc2ccccc12
InChIKey
PIVQQUNOTICCSA-UHFFFAOYSA-N
InChI
InChI=1S/C11H10N2S/c12-11(14)13-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H3,12,13,14)

Weigh it out

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

Names and synonyms

25 names · show all
  • Thiourea, N-1-naphthalenyl-
  • Urea, 1-(1-naphthyl)-2-thio-
  • Thiourea, 1-naphthalenyl-
  • N-1-Naphthalenylthiourea
  • Anturat
  • Bantu
  • ANTU
  • Chemical 109
  • Krysid
  • α-Naphthylthiocarbamide
  • α-Naphthylthiourea
  • 1-Naphthylthiourea
  • 1-(1-Naphthyl)-2-thiourea
  • N-1-Naphthylthiourea
  • Rattrack
  • U 5227
  • Kripid
  • Dirax
  • Alrato
  • Smeesana
  • Naphtox
  • 1-(1-Naphthyl)thiourea
  • NSC 3287
  • Naphthalen-1-ylthiourea
  • 1-(Naphthalen-1-yl)thiourea

Work with Alpha-naphthylthiourea

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

(2-Chlorophenyl)thiourea5344-82-161 % similar O-Tolylthiourea614-78-856 % similar N-(2-Fluorophenyl)thiourea656-32-656 % similar (2-Methoxyphenyl)thiourea1516-37-651 % similar N-[2-(Trifluoromethyl)phenyl]thiourea1736-71-651 % similar Phenylthiocarbamide103-85-550 % similar N-(2,6-Dimethylphenyl)thiourea6396-76-544 % similar 1-Naphthylhydrazine hydrochloride2243-56-344 % similar

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

Elsewhere

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