4-((2,4-Dichlorobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid
Basic information
- CAS
6528-49-0- Standard SMILES
O=C(Nc1ccc(S(=O)(=O)O)c2cc(S(=O)(=O)O)cc(O)c12)c1ccc(Cl)cc1Cl- InChIKey
JHXRWWCYQHFYAN-UHFFFAOYSA-N- Molecular formula
- C17H11Cl2NO8S2
- Average molar mass
- 492.3 g/mol
- Monoisotopic mass
- 490.930314
Names & identifiers
- Preferred name
- 4-((2,4-Dichlorobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid
- IUPAC
- 4-[(2,4-dichlorobenzoyl)amino]-5-hydroxynaphthalene-1,7-disulfonic acid
- English name
- 4-[(2,4-dichlorobenzoyl)amino]-5-hydroxynaphthalene-1,7-disulphonic acid
- Molecular formula
- C17H11Cl2NO8S2
- Molecular weight
- 492.31
Names & synonyms
6528-49-04-((2,4-Dichlorobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid4-[(2,4-dichlorobenzoyl)amino]-5-hydroxynaphthalene-1,7-disulfonic acidZWE8ZRG4PG4-((2,4-Dichlorobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulfonic acidEINECS 229-422-5UNII-ZWE8ZRG4PGSCHEMBL10942856DTXSID30215620JHXRWWCYQHFYAN-UHFFFAOYSA-N1,7-Naphthalenedisulfonic acid, 4-((2,4-dichlorobenzoyl)amino)-5-hydroxy-4-(2,4-DICHLOROBENZAMIDO)-5-HYDROXYNAPHTHALENE-1,7-DISULFONIC ACID
Show more names
8-(2,4-dichlorobenzamido)-1-naphthol-3,5-disulfonic acid4-(2,4-Dichlorobenzoylamino)-5-hydroxy-1,7-naphthalenedisulfonic acid4-[(2,4-dichlorobenzoyl)amino]-5-hydroxynaphthalene-1,7-disulphonic acid1,7-Naphthalenedisulfonic acid, 4-[(2,4-dichlorobenzoyl)amino]-5-hydroxy-
NS00035856
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 175 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 856
Physicochemical properties
- FDA UNII
- 8 ZRG4PG · ZWE8ZRG4PG
Chemistry & industry
Upstream & downstream products
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