1-Naphthalenesulfonic acid, 4-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-3-hydroxy-
Basic information
- CAS
14954-75-7- Standard SMILES
CC1=NN(c2ccccc2)C(=O)C1N=Nc1c(O)cc(S(=O)(=O)O)c2ccccc12- InChIKey
GQCUEANXEKPQGU-UHFFFAOYSA-N- Molecular formula
- C20H16N4O5S
- Average molar mass
- 424.4 g/mol
- Monoisotopic mass
- 424.0841408
Names & identifiers
- Preferred name
- 1-Naphthalenesulfonic acid, 4-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-3-hydroxy-
- IUPAC
- 3-hydroxy-4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]naphthalene-1-sulfonic acid
Names & synonyms
DTXSID908632271-Naphthalenesulfonic acid, 4-(2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl)-3-hydroxy-1-Naphthalenesulfonic acid, 4-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-3-hydroxy-RefChem:434880DTXCID3081188314954-75-71-Naphthalenesulfonic acid, 4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-3-hydroxy-Acid Chrome Bordeaux BC.I. Mordant Red 7Acid Chrome Bordeaux 2A1-Naphthalenesulfonic acid, 4-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-3-hydroxy-NSC47717
Show more names
C.I. 18760UNII-87R9RU27MV4-[[(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol)-4-yl]azo]-3-hydroxy-1-naphthalenesulfonic acidSCHEMBL162722SCHEMBL2549358SCHEMBL7601826GQCUEANXEKPQGU-UHFFFAOYSA-N3-hydroxy-4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]naphthalene-1-sulfonic acid
Database identifiers
- CAS
14954-75-7
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 818
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Naphthalenesulfonic acid, 4-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-3-hydroxy-: INACTIVE
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Related reactions
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Compound notes
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