2-(3-Chlorophenyl)-4-methyl-5-phenyl-1,3-oxazole
Basic information
- CAS
77876-76-7- Standard SMILES
Cc1nc(-c2cccc(Cl)c2)oc1-c1ccccc1- InChIKey
XJTAFGOXOAQBHN-UHFFFAOYSA-N- Molecular formula
- C16H12ClNO
- Average molar mass
- 269.72 g/mol
- Monoisotopic mass
- 269.0607417
Names & identifiers
- Preferred name
- 2-(3-Chlorophenyl)-4-methyl-5-phenyl-1,3-oxazole
- IUPAC
- 2-(3-chlorophenyl)-4-methyl-5-phenyl-1,3-oxazole
Names & synonyms
2-(3-chlorophenyl)-4-methyl-5-phenyl-1,3-oxazole77876-76-7NSC249762DTXSID70312081NSC-249762DS-0033132-(3-CHLOROPHENYL)-4-METHYL-5-PHENYLOXAZOLE
Database identifiers
- CAS
77876-76-7- PubChem CID
- 317503
- DTXSID
DTXSID70312081
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 292
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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