3-Trifluoromethylthio-benzoyl chloride

HCID 53679904
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Basic information

Standard SMILES
FC(F)(F)c1cccc(C(=S)Cl)c1
InChIKey
BFWSDVKKNDZYHA-UHFFFAOYSA-N
Molecular formula
C8H4ClF3S
Average molar mass
224.63 g/mol
Monoisotopic mass
223.9674335

Names & identifiers

Preferred name
3-Trifluoromethylthio-benzoyl chloride
IUPAC
3-(trifluoromethyl)benzenecarbothioyl chloride

Names & synonyms

3-trifluoromethylthio-benzoyl chlorideSCHEMBL14491753-trifluoromethyl-thiobenzoic acid chloride

Database identifiers

PubChem CID
53679904

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
32.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
13

Related reactions

5 records
New reaction record

Compound notes

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