1-[3-(Diphenylmethyl)-5-methyl-1,2-oxazol-4-yl]ethan-1-one
Basic information
- CAS
77854-04-7- Standard SMILES
CC(=O)c1c(C(c2ccccc2)c2ccccc2)noc1C- InChIKey
YBLUZVFVGIMJLU-UHFFFAOYSA-N- Molecular formula
- C19H17NO2
- Average molar mass
- 291.3 g/mol
- Monoisotopic mass
- 291.12592879
Names & identifiers
- Preferred name
- 1-[3-(Diphenylmethyl)-5-methyl-1,2-oxazol-4-yl]ethan-1-one
- IUPAC
- 1-(3-benzhydryl-5-methyl-1,2-oxazol-4-yl)ethanone
Names & synonyms
77854-04-71-(3-Benzhydryl-5-methylisoxazol-4-yl)ethanoneDTXSID005127741-[3-(Diphenylmethyl)-5-methyl-1,2-oxazol-4-yl]ethan-1-one
Database identifiers
- CAS
77854-04-7- PubChem CID
- 12911786
- DTXSID
DTXSID00512774
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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