chempirical

6-Chloronaphthalene-2-thiol

C10H7ClSCAS 392330-26-6194.68 g/mol

Open in Covalent MOL file
ClHS
Aryl halideThiol

Properties

Molecular formula
C10H7ClS
Molar mass
194.68 g/mol
Exact mass
193.9957 Da
logP
3.78Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

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
392330-26-6
SMILES
C1=CC2=C(C=CC(=C2)Cl)C=C1S
InChIKey
UNDQDTFBOZKROF-UHFFFAOYSA-N
InChI
InChI=1S/C10H7ClS/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6,12H

Weigh it out

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Names and synonyms

1 names
  • 6-Chloro-2-naphthalenethiol

Work with 6-Chloronaphthalene-2-thiol

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

4-Chlorobenzenethiol106-54-757 % similar 3-Chlorothiophenol2037-31-256 % similar 2-Chloronaphthalene91-58-756 % similar 2-Naphthalenethiol91-60-156 % similar 2-Chloroanthracene17135-78-354 % similar 6-Chloroisoquinoline62882-02-447 % similar 3,4-Dichlorobenzenethiol5858-17-344 % similar 3,5-Dichlorobenzenethiol17231-94-644 % similar

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

Elsewhere

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