Basic information
- CAS
93900-53-9- Standard SMILES
C=CC(c1cccc(Cl)c1)c1cc(C)ccc1O- InChIKey
ZIAVXJLPZPQKGV-UHFFFAOYSA-N- Molecular formula
- C16H15ClO
- Average molar mass
- 258.74 g/mol
- Monoisotopic mass
- 258.0811428
Names & identifiers
- Preferred name
- 2-[1-(3-Chlorophenyl)prop-2-enyl]-4-methylphenol
- IUPAC
- 2-[1-(3-chlorophenyl)prop-2-enyl]-4-methylphenol
Names & synonyms
93900-53-92-[1-(3-chlorophenyl)prop-2-enyl]-4-methylphenolNSC873952-[1-(3-chlorophenyl)prop-2-en-1-yl]-4-methylphenolDTXSID10293148NSC-87395
Database identifiers
- CAS
93900-53-9- PubChem CID
- 258477
- DTXSID
DTXSID10293148
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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