Basic information
- CAS
66302-37-2- Standard SMILES
Clc1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)o2)cc1- InChIKey
QDVJNAPZHAJGHK-UHFFFAOYSA-N- Molecular formula
- C21H14ClNO
- Average molar mass
- 331.8 g/mol
- Monoisotopic mass
- 331.0763918
Names & identifiers
- Preferred name
- 2-(4-Chlorophenyl)-4,5-diphenyl-1,3-oxazole
- IUPAC
- 2-(4-chlorophenyl)-4,5-diphenyl-1,3-oxazole
Names & synonyms
66302-37-22-(4-chlorophenyl)-4,5-diphenyl-1,3-oxazoleNSC316459DTXSID80317486NSC-316459
Database identifiers
- CAS
66302-37-2- PubChem CID
- 330165
- DTXSID
DTXSID80317486- Nikkaji
- J2.510.320C
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 383
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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