Basic information
- CAS
3701-40-4- Standard SMILES
Cc1cc(N=Nc2c(S(=O)(=O)[O-])cc3cc(S(=O)(=O)[O-])ccc3c2O)ccc1-c1ccc(N=Nc2c(O)ccc3ccccc23)cc1C.[Na+].[Na+]- InChIKey
CCOPUGSPAPWFFC-UHFFFAOYSA-L- Molecular formula
- C34H24N4Na2O8S2
- Average molar mass
- 726.7 g/mol
- Monoisotopic mass
- 726.08309465
Overview
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Names & identifiers
- Preferred name
- Disodium 4-hydroxy-3-((4'-((2-hydroxynaphthyl)azo)-2,2'-dimethyl(1,1'-biphenyl)-4-yl)azo)naphthalene-2,7-disulphonate
- IUPAC
- disodium;4-hydroxy-3-[[4-[4-[(2-hydroxynaphthalen-1-yl)diazenyl]-2-methylphenyl]-3-methylphenyl]diazenyl]naphthalene-2,7-disulfonate
- English name
- disodium 4-hydroxy-3-[[4'-[(2-hydroxynaphthyl)azo]-2,2'-dimethyl[1,1'-biphenyl]-4-yl]azo]naphthalene-2,7-disulphonate
- Molecular formula
- C34H24N4Na2O8S2
- Molecular weight
- 726.6859
Names & synonyms
Disodium 4-hydroxy-3-((4'-((2-hydroxynaphthyl)azo)-2,2'-dimethyl(1,1'-biphenyl)-4-yl)azo)naphthalene-2,7-disulphonate2,7-Naphthalenedisulfonic acid, 4-hydroxy-3-(2-(4'-(2-(2-hydroxy-1-naphthalenyl)diazenyl)-2,2'-dimethyl(1,1'-biphenyl)-4-yl)diazenyl)-, sodium salt (1:2)Disodium 4-hydroxy-3-[[4'-[(2-hydroxynaphthyl)azo]-2,2'-dimethyl[1,1'-biphenyl]-4-yl]azo]naphthalene-2,7-disulphonate2,7-Naphthalenedisulfonic acid, 4-hydroxy-3-[2-[4'-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-2,2'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl]-, sodium salt (1:2)RefChem:589383223-040-2Acid Red 993701-40-4Acidine Red RDCoomassie Red RAiredale Red RMKayanol Red RS
Show more names
ACIDRED99C.I. Acid Red 99Acid red 99 (C.I. 23285)C.I.Acid Red 99:C.I.232852,7-Naphthalenedisulfonic acid, 4-hydroxy-3-[[4'-[(2-hydroxy- 1-naphthalenyl)azo]-2,2'-dimethyl[1,1'-biphenyl ]-4-yl]azo]-, disodium salt
Properties
Computed structural properties
- Topological polar surface area
- 221 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 5
- Heavy atoms
- 50
- Formal charge
- 0
- Complexity
- 1,360
Physicochemical properties
- EPA Substance Registry System
- 2 · 2,7-Naphthalenedisulfonic acid, 4-hydroxy-3-[[4'-[(2-hydroxy-1-naphthalenyl)azo]-2,2'-dimethyl[1,1'-biphenyl]-4-yl]azo]-, disodium salt (3701-40-4)
- 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.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.
Not Classified
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationHazard Traits - Bioaccumulation; Environmental Persistence
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2,7-Naphthalenedisulfonic acid, 4-hydroxy-3-[2-[4'-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-2,2'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl]-, sodium salt (1:2): INACTIVE
Preparation methods
Preparation4-(4-Amino-2-methylphenyl)-3-methylbenzenamine double nitriding, respectively with the 4-Hydroxynaphthalene-2,7-disulfonic acid and Naphthalen-2-ol coupling.
Upstream & downstream products
Upstream raw materials
Suppliers1 total
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
Related reactions
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Compound notes
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