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4-Nitrophenyl

HCID 119211
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Basic information

CAS
2395-99-5
Standard SMILES
O=[N+]([O-])c1cc[c]cc1
InChIKey
ZHCAAFJSYLFLPX-UHFFFAOYSA-N
Molecular formula
C6H4NO2
Average molar mass
122.1 g/mol
Monoisotopic mass
122.02420337

Names & identifiers

Preferred name
4-Nitrophenyl
IUPAC
4-Nitrophenyl
English name
p-Nitrophenyl radical
Molecular weight
0

Names & synonyms

para-Nitrophenyl2395-99-5DTXSID401317739RefChem:100080DTXCID8017475424-Nitrophenylp-Nitrophenyl radical4-Nitrophenyl 2-Acetamido-2-deoxy-(6-O-2-acetamido-2-deoxy-α-D-gluco-pyranosyl)-α-D-galactopyranoside

Database identifiers

CAS
2395-99-5
PubChem CID
119211
DTXSID
DTXSID401317739
Nikkaji
J1.165.149F、J1.748.785J、J259.180D

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
45.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Formal charge
0
Complexity
102

Physicochemical properties

Melting point
86 °C · 86 °C

Chemistry & industry

Applications

UsesAn analogue of p-nitrophenyl T-antigen as potential substrate for elucidation of the substrate specificity of endo-α-N-acetylgalactosaminidase.

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Compound notes

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