Basic information
- CAS
57427-79-9- Standard SMILES
Cc1ccc(/C=C2\N=C(c3ccccc3)OC2=O)cc1- InChIKey
IFRAFVGTPWYBBQ-PTNGSMBKSA-N- Molecular formula
- C17H13NO2
- Average molar mass
- 263.29 g/mol
- Monoisotopic mass
- 263.09462866
Names & identifiers
- Preferred name
- (4Z)-4-[(4-Methylphenyl)methylene]-2-phenyl-5(4H)-oxazolone
- IUPAC
- (4Z)-4-[(4-methylphenyl)methylidene]-2-phenyl-1,3-oxazol-5-one
Names & synonyms
57427-79-9(4Z)-4-[(4-Methylphenyl)methylene]-2-phenyl-5(4H)-oxazolone(4Z)-4-((4-Methylphenyl)methylene)-2-phenyl-5(4H)-oxazoloneRefChem:209304(Z)-4-(4-Methylbenzylidene)-2-phenyloxazol-5(4H)-one(4Z)-4-[(4-methylphenyl)methylidene]-2-phenyl-4,5-dihydro-1,3-oxazol-5-one4-[(4-methylphenyl)methylene]-2-phenyl-1,3-oxazolin-5-oneHMS561P15DTXSID501190712SBB038847STL417010AKOS000267020
Show more names
DB-336427ST50118223(4Z)-4-(4-methylbenzylidene)-2-phenyl-1,3-oxazol-5(4H)-one(4Z)-4-[(4-Methylphenyl)methylidene]-2-phenyl-1,3-oxazol-5(4H)-one
Database identifiers
- CAS
57427-79-9- PubChem CID
- 708337
- DTXSID
DTXSID501190712- Nikkaji
- J402.035I
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 424
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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