Basic information
- CAS
6358-47-0- Standard SMILES
Cc1ccc([N+](=O)[O-])cc1N=Nc1c(O)c(C(=O)Nc2cccc([N+](=O)[O-])c2)cc2ccccc12- InChIKey
VOQHKBYZRLXPBY-UHFFFAOYSA-N- Molecular formula
- C24H17N5O6
- Average molar mass
- 471.4 g/mol
- Monoisotopic mass
- 471.11788328
Names & identifiers
- Preferred name
- 3-Hydroxy-4-(2-(2-methyl-5-nitrophenyl)diazenyl)-N-(3-nitrophenyl)-2-naphthalenecarboxamide
- IUPAC
- 3-hydroxy-4-[(2-methyl-5-nitrophenyl)diazenyl]-N-(3-nitrophenyl)naphthalene-2-carboxamide
- English name
- 3-hydroxy-4-[(2-methyl-5-nitrophenyl)azo]-N-(3-nitrophenyl)naphthalene-2-carboxamide
- Molecular formula
- C24H17N5O6
- Molecular weight
- 471.42
Names & synonyms
6358-47-03-Hydroxy-4-(2-(2-methyl-5-nitrophenyl)diazenyl)-N-(3-nitrophenyl)-2-naphthalenecarboxamide3-Hydroxy-4-[2-(2-methyl-5-nitrophenyl)diazenyl]-N-(3-nitrophenyl)-2-naphthalenecarboxamideRefChem:279851EINECS 228-774-73-Hydroxy-4-((2-methyl-5-nitrophenyl)azo)-N-(3-nitrophenyl)naphthalene-2-carboxamideSCHEMBL16323369SCHEMBL16323370SCHEMBL21436609SCHEMBL29353453VOQHKBYZRLXPBY-UHFFFAOYSA-NNS00043873
Show more names
Pigment red 114 (C.I. 12351)3-hydroxy-4-[(2-methyl-5-nitrophenyl)azo]-N-(3-nitrophenyl)naphthalene-2-carboxamide2-Naphthalenecarboxamide, 3-hydroxy-4-[2-(2-methyl-5-nitrophenyl)diazenyl]-N-(3-nitrophenyl)-
Database identifiers
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 166 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 813
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 2-Naphthalenecarboxamide, 3-hydroxy-4-[(2-methyl-5-nitrophenyl)azo]-N-(3-nitrophenyl)-
Other Safety InformationIMAP assessments - Monoazo pigments that may release carcinogenic amines: Human health tier II assessment
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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