Basic information
- CAS
7402-72-4- Standard SMILES
O=C(/C=C\c1ccc(Cl)c(Cl)c1)c1cccs1- InChIKey
WYBSEBZDXWKGMZ-XQRVVYSFSA-N- Molecular formula
- C13H8Cl2OS
- Average molar mass
- 283.2 g/mol
- Monoisotopic mass
- 281.9672914
Names & identifiers
- Preferred name
- (Z)-3-(3,4-dichlorophenyl)-1-thiophen-2-ylprop-2-en-1-one
- IUPAC
- (Z)-3-(3,4-dichlorophenyl)-1-thiophen-2-ylprop-2-en-1-one
Names & synonyms
NSC400314NSC-400314
Database identifiers
- CAS
7402-72-4- PubChem CID
- 54604751
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 306
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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