5-(4-nitrophenyl)-3H-1,3-oxazol-2-one

HCID 822133
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Basic information

Standard SMILES
O=c1[nH]cc(-c2ccc([N+](=O)[O-])cc2)o1
InChIKey
SEHUDHVEXGRFKF-UHFFFAOYSA-N
Molecular formula
C9H6N2O4
Average molar mass
206.15 g/mol

Names & identifiers

Preferred name
5-(4-nitrophenyl)-3H-1,3-oxazol-2-one
IUPAC
5-(4-nitrophenyl)-3H-1,3-oxazol-2-one

Names & synonyms

5-(4-Nitrophenyl)-1,3-oxazol-2(3H)-one5-{4-nitrophenyl}-1,3-oxazol-2(3H)-one5-(4-nitrophenyl)-3H-1,3-oxazol-2-oneSCHEMBL16137832SEHUDHVEXGRFKF-UHFFFAOYSA-NAB-131/42302856

Database identifiers

PubChem CID
822133

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
84.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
15

Related reactions

2 records
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Compound notes

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