Basic information
- Standard SMILES
Cc1ccc(C(=O)C=Cc2ccccc2)s1- InChIKey
AOUMOFQEBZGSPD-UHFFFAOYSA-N- Molecular formula
- C14H12OS
- Average molar mass
- 228.31 g/mol
Names & identifiers
- Preferred name
- 2-Propen-1-one,1-(5-methyl-2-thienyl)-3-phenyl-
- IUPAC
- 1-(5-methylthiophen-2-yl)-3-phenylprop-2-en-1-one
Names & synonyms
2-Propen-1-one,1-(5-methyl-2-thienyl)-3-phenyl-SCHEMBL8664746AOUMOFQEBZGSPD-UHFFFAOYSA-NBBA90326AKOS017100994
Database identifiers
- PubChem CID
- 238607
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 266
Related reactions
2 records
Compound notes
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