Completing data — usually done within a minute
Basic information
- CAS
918164-58-6- Standard SMILES
Cc1cc(-c2ccc(C(F)(F)F)cc2)sc1CCl- InChIKey
BHRSOTIBPHOIBW-UHFFFAOYSA-N- Molecular formula
- C13H10ClF3S
- Average molar mass
- 290.73 g/mol
- Monoisotopic mass
- 290.0143837
Names & identifiers
- Preferred name
- 2-(Chloromethyl)-3-methyl-5-[4-(trifluoromethyl)phenyl]thiophene
- IUPAC
- 2-(chloromethyl)-3-methyl-5-[4-(trifluoromethyl)phenyl]thiophene
Names & synonyms
2-(Chloromethyl)-3-methyl-5-[4-(trifluoromethyl)phenyl]thiophene918164-58-6SCHEMBL2244394DTXSID905801292-(Chloromethyl)-5-(4-(trifluoromethyl)phenyl)-3-methylthiophene
Database identifiers
- CAS
918164-58-6- PubChem CID
- 15946281
- DTXSID
DTXSID90580129
Properties
Computed structural propertiesFilling in
- XLogP
- 4.9
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 274
Related reactions
6 records
Compound notes
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