4-Nitrophenyl 3-chlorobenzoate

HCID 8108310
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Basic information

Standard SMILES
O=C(Oc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1
InChIKey
ZDRYPPICSNKLEV-UHFFFAOYSA-N
Molecular formula
C13H8ClNO4
Average molar mass
277.66 g/mol

Names & identifiers

Preferred name
4-Nitrophenyl 3-chlorobenzoate
IUPAC
(4-nitrophenyl) 3-chlorobenzoate

Names & synonyms

4-nitrophenyl 3-chlorobenzoateSCHEMBL6865567CHEMBL3272637AKOS0035011643-Chlorobenzoic acid, 4-nitrophenyl ester

Database identifiers

PubChem CID
8108310
ChEMBL
CHEMBL3272637
Nikkaji
J838.918G

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
72.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
19

Related reactions

1 records
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Compound notes

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