Basic information
- CAS
27757-95-5- Standard SMILES
Cc1cc(N=Nc2c(O)c(C(=O)O)cc3ccccc23)c(S(=O)(=O)O)cc1Cl- InChIKey
BZRQQRFJGITEMV-UHFFFAOYSA-N- Molecular formula
- C18H13ClN2O6S
- Average molar mass
- 420.8 g/mol
- Monoisotopic mass
- 420.018285
Names & identifiers
- Preferred name
- 4-[2-(4-Chloro-5-methyl-2-sulfophenyl)diazenyl]-3-hydroxy-2-naphthalenecarboxylic acid
- IUPAC
- 4-[(4-chloro-5-methyl-2-sulfophenyl)diazenyl]-3-hydroxynaphthalene-2-carboxylic acid
- English name
- 4-[(4-chloro-5-methyl-2-sulphophenyl)azo]-3-hydroxy-2-naphthoic acid
- Molecular formula
- C18H13ClN2O6S
- Molecular weight
- 420.82
Names & synonyms
27757-95-54-(2-(4-Chloro-5-methyl-2-sulfophenyl)diazenyl)-3-hydroxy-2-naphthalenecarboxylic acid4-[2-(4-Chloro-5-methyl-2-sulfophenyl)diazenyl]-3-hydroxy-2-naphthalenecarboxylic acidRefChem:198549UNII-7D2R7XP16D7D2R7XP16DEINECS 248-640-12-Naphthalenecarboxylic acid, 4-((4-chloro-5-methyl-2-sulfophenyl)azo)-3-hydroxy-2-Naphthalenecarboxylic acid, 4-(2-(4-chloro-5-methyl-2-sulfophenyl)diazenyl)-3-hydroxy-4-((4-Chloro-5-methyl-2-sulphophenyl)azo)-3-hydroxy-2-naphthoic acidJ32.167BSCHEMBL6846274
Show more names
4-[(4-chloro-5-methyl-2-sulphophenyl)azo]-3-hydroxy-2-naphthoic acid2-(2-Hydroxy-3-carboxy-1-naphtylazo)-4-methyl-5-chlorobenzenesulfonic acid4-(4-Chloro-5-methyl-2-sulfophenylazo)-3-hydroxy-2-naphthalenecarboxylic acid2-Naphthalenecarboxylic acid, 4-[2-(4-chloro-5-methyl-2-sulfophenyl)diazenyl]-3-hydroxy-
SCHEMBL6846275DTXSID9041734SCHEMBL29396474BZRQQRFJGITEMV-UHFFFAOYSA-N2-(2-Hydroxy-3-carboxy-1-naphthylazo)-4-methyl-5-chlorobenzenesulfonic acidNS00083723Q272680924-[(4-Chloro-5-methyl-2-sulfophenyl)diazenyl]-3-hydroxynaphthalene-2-carboxylic acid
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 711
Physicochemical properties
- FDA UNII
- 7 D2R7XP16D · 7D2R7XP16D
- EPA Substance Registry System
- 52 · C.I. Pigment Red 52 (27757-95-5)
- 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-Naphthalenecarboxylic acid, 4-[2-(4-chloro-5-methyl-2-sulfophenyl)diazenyl]-3-hydroxy-: INACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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