5-Chloro-2-phenyl-4-oxazolecarboxaldehyde
Basic information
- CAS
54644-13-2- Standard SMILES
O=Cc1nc(-c2ccccc2)oc1Cl- InChIKey
SGGNPXOWWKFBAQ-UHFFFAOYSA-N- Molecular formula
- C10H6ClNO2
- Average molar mass
- 207.61 g/mol
- Monoisotopic mass
- 207.0087061
Names & identifiers
- Preferred name
- 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde
- IUPAC
- 5-chloro-2-phenyl-1,3-oxazole-4-carbaldehyde
Names & synonyms
54644-13-25-Chloro-2-phenyl-4-oxazolecarboxaldehydeRefChem:3024585-chloro-2-phenyloxazole-4-carbaldehyde5-chloro-2-phenyl-1,3-oxazole-4-carbaldehydeDTXSID301270956AKOS004904460
Database identifiers
- CAS
54644-13-2- PubChem CID
- 2748878
- DTXSID
DTXSID301270956- Nikkaji
- J2.902.037J
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 206
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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