4-(2-Nitrophenyl)-3-buten-2-one

HCID 140761
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Basic information

Standard SMILES
CC(=O)C=Cc1ccccc1[N+](=O)[O-]
InChIKey
FRPAGLRAZLFTGW-UHFFFAOYSA-N
Molecular formula
C10H9NO3
Average molar mass
191.18 g/mol

Names & identifiers

Preferred name
4-(2-Nitrophenyl)-3-buten-2-one
IUPAC
4-(2-nitrophenyl)but-3-en-2-one

Names & synonyms

o-nitrobenzalacetoneSCHEMBL1404905FRPAGLRAZLFTGW-UHFFFAOYSA-N4-(2-nitrophenyl)-3-buten-2-oneAKOS017414362

Database identifiers

PubChem CID
140761

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
62.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
14

Related reactions

1 records
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Compound notes

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