Benzeneacetic acid, 4-(5-methoxy-4-phenyl-2-oxazolyl)-, methyl ester
Basic information
- CAS
80589-81-7- Standard SMILES
COC(=O)Cc1ccc(-c2nc(-c3ccccc3)c(OC)o2)cc1- InChIKey
LLYYZXPSIWLMSA-UHFFFAOYSA-N- Molecular formula
- C19H17NO4
- Average molar mass
- 323.3 g/mol
- Monoisotopic mass
- 323.11575802
Names & identifiers
- Preferred name
- Benzeneacetic acid, 4-(5-methoxy-4-phenyl-2-oxazolyl)-, methyl ester
- IUPAC
- methyl 2-[4-(5-methoxy-4-phenyl-1,3-oxazol-2-yl)phenyl]acetate
Names & synonyms
BRN 4538679Benzeneacetic acid, 4-(5-methoxy-4-phenyl-2-oxazolyl)-, methyl ester80589-81-7Methyl 4-(5-methoxy-4-phenyl-2-oxazolyl)benzeneacetateDTXSID20230423RefChem:324210DTXCID20152914Methyl [4-(5-methoxy-4-phenyl-1,3-oxazol-2-yl)phenyl]acetate
Database identifiers
- CAS
80589-81-7- PubChem CID
- 3062298
- DTXSID
DTXSID20230423
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 402
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Compound notes
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