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2-Naphthalenecarboxamide, N-(2-ethylphenyl)-3-hydroxy-4-[2-(4-methoxy-2-nitrophenyl)diazenyl]-

HCID 174895
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Basic information

CAS
72088-87-0
Standard SMILES
CCc1ccccc1NC(=O)c1cc2ccccc2c(N=Nc2ccc(OC)cc2[N+](=O)[O-])c1O
InChIKey
WCYYHGULXDORSH-UHFFFAOYSA-N
Molecular formula
C26H22N4O5
Average molar mass
470.5 g/mol
Monoisotopic mass
470.15901982

Names & identifiers

Preferred name
2-Naphthalenecarboxamide, N-(2-ethylphenyl)-3-hydroxy-4-[2-(4-methoxy-2-nitrophenyl)diazenyl]-
IUPAC
N-(2-ethylphenyl)-3-hydroxy-4-[(4-methoxy-2-nitrophenyl)diazenyl]naphthalene-2-carboxamide
English name
N-(2-ethylphenyl)-3-hydroxy-4-[(4-methoxy-2-nitrophenyl)azo]naphthalene-2-carboxamide
Molecular formula
C26H22N4O5
Molecular weight
470.48

Names & synonyms

EINECS 276-330-62-Naphthalenecarboxamide, N-(2-ethylphenyl)-3-hydroxy-4-[(4-methoxy-2-nitrophenyl)azo]-1-((2-Nitro-4-methoxyphenyl)azo)-2-hydroxy-3-naphthoic acid o-ethylanilide2-Naphthalenecarboxamide, N-(2-ethylphenyl)-3-hydroxy-4-((4-methoxy-2-nitrophenyl)azo)-2-Naphthalenecarboxamide, N-(2-ethylphenyl)-3-hydroxy-4-(2-(4-methoxy-2-nitrophenyl)diazenyl)-2-Naphthalenecarboxamide, N-(2-ethylphenyl)-3-hydroxy-4-[2-(4-methoxy-2-nitrophenyl)diazenyl]-RefChem:47654072088-87-0N-(2-ETHYLPHENYL)-3-HYDROXY-4-[(4-METHOXY-2-NITROPHENYL)AZO]NAPHTHALENE-2-CARBOXAMIDEN-(2-Ethylphenyl)-3-hydroxy-4-((4-methoxy-2-nitrophenyl)azo)naphthalene-2-carboxamideDTXSID9072492WCYYHGULXDORSH-UHFFFAOYSA-N
Show more names
N-(2-Ethylphenyl)-3-hydroxy-4-[(4-methoxy-2-nitrophenyl)azo]-2-naphthalenecarboxamide
NS00037331N-(2-Ethylphenyl)-3-hydroxy-4-[(4-methoxy-2-nitrophenyl)diazenyl]naphthalene-2-carboxamide

Properties

Computed structural properties

XLogP
6.6
Topological polar surface area
129 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
35
Formal charge
0
Complexity
759

Physicochemical properties

Boiling point
654.051 · 654.051±55.00 °C(Press: 760.00 Torr)(predicted)
Density
1.324 · 1.324±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
11.978 · 11.978±0.70(predicted)
EPA Substance Registry System
2 · 2-Naphthalenecarboxamide, N-(2-ethylphenyl)-3-hydroxy-4-[(4-methoxy-2-nitrophenyl)azo]- (72088-87-0)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2-Naphthalenecarboxamide, N-(2-ethylphenyl)-3-hydroxy-4-[2-(4-methoxy-2-nitrophenyl)diazenyl]-: INACTIVE

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Compound notes

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Database identifiers

CAS
72088-87-0
PubChem CID
174895
DTXSID
DTXSID9072492
EC Number
276-330-6
Nikkaji
J295.141J