2-(1,2-Oxazol-3-yl)phenyl acetate

HCID 12392002

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Basic information

CAS: 65479-01-8
Standard SMILES: CC(=O)Oc1ccccc1-c1ccon1
InChIKey: VSTOCZRNGGABNT-UHFFFAOYSA-N
Molecular formula: C11H9NO3
Average molar mass: 203.19 g/mol
Monoisotopic mass: 203.05824315

Names & identifiers

Preferred name: 2-(1,2-Oxazol-3-yl)phenyl acetate
IUPAC: [2-(1,2-oxazol-3-yl)phenyl] acetate
English name: 3-(2-Acetyloxyphenyl)isoxazole
Molecular formula: C11H9NO3
Molecular weight: 203.19

Names & synonyms

2-(1,2-Oxazol-3-yl)phenyl acetateDTXSID3049603365479-01-8RefChem:249598DTXCID004468433-(2-Acetyloxyphenyl)isoxazole2-(3-Isoxazolyl)phenol acetatePhenol, 2-(3-isoxazolyl)-, 1-acetate

Database identifiers

CAS: 65479-01-8
PubChem CID: 12392002
DTXSID: DTXSID30496033
Nikkaji: J131.921C

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 52.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 232

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