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2H-Naphtho[1,2-d]triazole-6,8-disulfonic acid, 2-(4-nitrophenyl)-

HCID 67226
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Basic information

CAS
130-34-7
Standard SMILES
O=[N+]([O-])c1ccc(-n2nc3ccc4c(S(=O)(=O)O)cc(S(=O)(=O)O)cc4c3n2)cc1
InChIKey
YHIPGHKFOXNVKS-UHFFFAOYSA-N
Molecular formula
C16H10N4O8S2
Average molar mass
450.4 g/mol
Monoisotopic mass
449.99400564

Names & identifiers

Preferred name
2H-Naphtho[1,2-d]triazole-6,8-disulfonic acid, 2-(4-nitrophenyl)-
IUPAC
2-(4-nitrophenyl)benzo[e]benzotriazole-6,8-disulfonic acid
English name
2-(p-nitrophenyl)-2H-naphtho[1,2-d]triazole-6,8-disulphonic acid
Molecular formula
C16H10N4O8S2
Molecular weight
450.4

Names & synonyms

EINECS 204-986-5L2DF6E4ND32-(p-nitrophenyl)-2H-naphtho[1,2-d]triazole-6,8-disulphonic acid2H-Naphtho[1,2-d]triazole-6,8-disulfonic acid, 2-(4-nitrophenyl)-DTXSID50596122H-Naphtho(1,2-d)triazole-6,8-disulfonic acid, 2-(4-nitrophenyl)-2-(p-Nitrophenyl)-2H-naphtho(1,2-d)triazole-6,8-disulphonic acid2-(4-Nitrophenyl)-2H-naphtho[1,2-d]triazole-6,8-disulfonic acid2-(4-NITROPHENYL)-2H-NAPHTHO(1,2-D)TRIAZOLE-6,8-DISULFONIC ACIDRefChem:90120DTXCID3033939130-34-7
Show more names
2-(4-nitrophenyl)-2h-naphtho[1,2-d][1,2,3]triazole-6,8-disulfonic acid2-(4-nitrophenyl)benzo[e]benzotriazole-6,8-disulfonic acidYHIPGHKFOXNVKS-UHFFFAOYSA-NUNII-L2DF6E4ND3NS000240982-(4-nitrophenyl)-2h-naphtho[1,2-d][1,2,3]triazole-6,8-disulfonicacid

Database identifiers

CAS
130-34-7
PubChem CID
67226
DTXSID
DTXSID5059612
UNII
L2DF6E4ND3
EC Number
204-986-5
Nikkaji
J184.373G

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
202 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
10
Rotatable bonds
3
Heavy atoms
30
Formal charge
0
Complexity
872

Physicochemical properties

FDA UNII
2 DF6E4ND3 · L2DF6E4ND3
EPA Substance Registry System
2 H-Naphtho[1,2-d]triazole-6,8-disulfonic · 2H-Naphtho[1,2-d]triazole-6,8-disulfonic acid, 2-(4-nitrophenyl)- (130-34-7)
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 Information2H-Naphtho[1,2-d]triazole-6,8-disulfonic acid, 2-(4-nitrophenyl)-: INACTIVE

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Compound notes

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