1-Naphthalenesulfonic acid, 6-(2-(5-chloro-2-hydroxy-3-sulfophenyl)diazenyl)-5-hydroxy-, sodium salt (1:2)
Basic information
- CAS
3624-68-8- Standard SMILES
O=S(=O)([O-])c1cc(Cl)cc(N=Nc2ccc3c(S(=O)(=O)[O-])cccc3c2O)c1O.[Na+].[Na+]- InChIKey
UVDODHCPLWXDSI-UHFFFAOYSA-L- Molecular formula
- C16H9ClN2Na2O8S2
- Average molar mass
- 502.8 g/mol
- Monoisotopic mass
- 501.9284239
Names & identifiers
- Preferred name
- 1-Naphthalenesulfonic acid, 6-(2-(5-chloro-2-hydroxy-3-sulfophenyl)diazenyl)-5-hydroxy-, sodium salt (1:2)
- IUPAC
- disodium;6-[(5-chloro-2-hydroxy-3-sulfonatophenyl)diazenyl]-5-hydroxynaphthalene-1-sulfonate
- English name
- 6-(5-Chloro-2-hydroxy-4-sulfophenylazo)-5-hydroxy-1-naphthalenesulfonic acid disodium salt
- Molecular formula
- C16H9ClN2Na2O8S2
- Molecular weight
- 502.81
Names & synonyms
EINECS 222-828-31-Naphthalenesulfonic acid, 6-((5-chloro-2-hydroxy-3-sulfophenyl)azo)-5-hydroxy-, disodium salt1-Naphthalenesulfonic acid, 6-(2-(5-chloro-2-hydroxy-3-sulfophenyl)diazenyl)-5-hydroxy-, sodium salt (1:2)1-Naphthalenesulfonic acid, 6-[(5-chloro-2-hydroxy-3-sulfophenyl)azo]-5-hydroxy-, disodium salt1-Naphthalenesulfonic acid, 6-[2-(5-chloro-2-hydroxy-3-sulfophenyl)diazenyl]-5-hydroxy-, sodium salt (1:2)RefChem:4349341-Naphthalenesulfonic acid, 6-(5-chloro-2-hydroxy-3-sulfophenyl)azo-5-hydroxy-, disodium saltMordant Blue 9C.I. MORDANT BLUE 9, DISODIUM SALT6-(5-Chloro-2-hydroxy-4-sulfophenylazo)-5-hydroxy-1-naphthalenesulfonic acid disodium saltdisodium;6-[(5-chloro-2-hydroxy-3-sulfonatophenyl)diazenyl]-5-hydroxynaphthalene-1-sulfonateSCHEMBL590710
Show more names
CI 14855Fast Navy 2RNavy Blue RLMordant Blue 2RLC.I.Mordantblue9AcidmordantblueA3R
Properties
Computed structural properties
- Topological polar surface area
- 196 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 2
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 798
Physicochemical properties
- storage temp.
- room temp
- solubility
- 2 O: · H2O: 1 mg/mL
- form
- Fine Crystalline Powder
- Colour Index
- 14855 · 14855
- color
- Dark blue
- Water Solubility
- 2 O: · H2O: 1mg/mL
- λmax
- 516 nm · 516 nm
- Major Application
- diagnostic assay manufacturinghematologyhistology
- InChIKey
- FBNOWTWLVCWGCZ-BUFQOAPZSA-L
- SMILES
- [Na+].[Na+].Oc1c(cc(Cl)cc1S([O-])(=O)=O)\N=N\c2ccc3c(cccc3c2O)S([O-])(=O)=O
- EPA Substance Registry System
- 9 · C.I. Mordant Blue 9, disodium salt (3624-68-8)
- UNSPSC Code
- 12171500 · 12171500
- NACRES
- 47 · NA.47
- Safety Statements
- 24 · 24/25
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HS Code
- 32041200 · 32041200
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 Information
Chemical: 1-Naphthalenesulfonic acid, 6-[(5-chloro-2-hydroxy-3-sulfophenyl)azo]-5-hydroxy-, disodium salt
1-Naphthalenesulfonic acid, 6-(5-chloro-2-hydroxy-3-sulfophenyl)azo-5-hydroxy-, disodium salt: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 1-Naphthalenesulfonic acid, 6-[(5-chloro-2-hydroxy-3-sulfophenyl)azo]-5-hydroxy-, disodium salt: Human health tier I assessment
Safety data
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 32041200
- safety_code
- 24/25
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Naphthalenesulfonic acid, 6-[2-(5-chloro-2-hydroxy-3-sulfophenyl)diazenyl]-5-hydroxy-, sodium salt (1:2): ACTIVE
Applications
Usesdiagnostic assay manufacturinghematologyhistology
Preparation methods
Preparation3-Amino-5-chloro-2-hydroxybenzenesulfonic acid diazotization, and 5-Hydroxynaphthalene-1-sulfonic acidcoupling.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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