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N-formyl-4-nitrophenylhydroxylamine

HCID 55289
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Basic information

CAS
84736-60-7
Standard SMILES
O=CN(O)c1ccc([N+](=O)[O-])cc1
InChIKey
QRYSGJONVHFLGS-UHFFFAOYSA-N
Molecular formula
C7H6N2O4
Average molar mass
182.13 g/mol
Monoisotopic mass
182.03275668

Overview

structure given in first source

Names & identifiers

Preferred name
N-formyl-4-nitrophenylhydroxylamine
IUPAC
N-hydroxy-N-(4-nitrophenyl)formamide
English name
N-formyl-4-nitrophenylhydroxylamine
Molecular formula
C7H6N2O4
Molecular weight
182.13

Names & synonyms

N-Formyl-4-nitrophenylhydroxylamine84736-60-7UCW244918UFORMAMIDE, N-HYDROXY-N-(4-NITROPHENYL)-DTXSID00233755N-formyl-para-nitrophenylhydroxylamineFoNPHRefChem:927161DTXCID30156246N-Formyl-p-nitrophenylhydroxylamineN-hydroxy-N-(4-nitrophenyl)formamideCCRIS 5517
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UNII-UCW244918USCHEMBL13356603

Database identifiers

CAS
84736-60-7
PubChem CID
55289
DTXSID
DTXSID00233755
UNII
UCW244918U

Properties

Computed structural propertiesFilling in

XLogP
0.6
Topological polar surface area
86.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
195

Physicochemical properties

Melting point
135 · 135-136 °C (decomp)
Boiling point
399.3 · 399.3±44.0 °C(Predicted)
Density
1.548 · 1.548±0.06 g/cm3(Predicted)
pka
4.69 · 4.69±0.70(Predicted)
FDA UNII
244918 U · UCW244918U

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Compound notes

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