Disodium 5-((4'-((2-amino-8-hydroxy-6-sulphonato-1-naphthyl)azo)(1,1'-biphenyl)-4-yl)azo)salicylate
Basic information
- CAS
2429-84-7- Standard SMILES
Nc1ccc2cc(S(=O)(=O)[O-])cc(O)c2c1N=Nc1ccc(-c2ccc(N=Nc3ccc(O)c(C(=O)[O-])c3)cc2)cc1.[Na+].[Na+]- InChIKey
YCMOBGSVZYLYBZ-UHFFFAOYSA-L- Molecular formula
- C29H19N5Na2O7S
- Average molar mass
- 627.5 g/mol
- Monoisotopic mass
- 627.08005751
Names & identifiers
- Preferred name
- Disodium 5-((4'-((2-amino-8-hydroxy-6-sulphonato-1-naphthyl)azo)(1,1'-biphenyl)-4-yl)azo)salicylate
- IUPAC
- disodium;5-[[4-[4-[(2-amino-8-hydroxy-6-sulfonatonaphthalen-1-yl)diazenyl]phenyl]phenyl]diazenyl]-2-hydroxybenzoate
- English name
- disodium 5-[[4'-[(2-amino-8-hydroxy-6-sulphonato-1-naphthyl)azo][1,1'-biphenyl]-4-yl]azo]salicylate
- Molecular formula
- C29H22N5NaO7S
- Molecular weight
- 607.57
Names & synonyms
Direct Red 1Disodium 5-((4'-((2-amino-8-hydroxy-6-sulphonato-1-naphthyl)azo)(1,1'-biphenyl)-4-yl)azo)salicylateBenzoic acid, 5-(2-(4'-(2-(2-amino-8-hydroxy-6-sulfo-1-naphthalenyl)diazenyl)(1,1'-biphenyl)-4-yl)diazenyl)-2-hydroxy-, sodium salt (1:2)Disodium 5-[[4'-[(2-amino-8-hydroxy-6-sulphonato-1-naphthyl)azo][1,1'-biphenyl]-4-yl]azo]salicylateBenzoic acid, 5-[2-[4'-[2-(2-amino-8-hydroxy-6-sulfo-1-naphthalenyl)diazenyl][1,1'-biphenyl]-4-yl]diazenyl]-2-hydroxy-, sodium salt (1:2)RefChem:589401219-393-7C.I. Direct Red 1, disodium salt2429-84-7C.I. Direct Red 1Cutamin Red CFDirect Red F
Show more names
C.I.22310CIDIRECTRED1Neonyl Red 2BMordant Red 57azine fast red fcChrome Fast Red Famanil fast red fsEnianil Fast Red F
Airedale Red FDDiphenyl Red BVondacel Red FNDirect Red KhDirect Rose MNFixanol Red FSMetachrome Red FDirect Red M
Properties
Computed structural properties
- Topological polar surface area
- 222 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 5
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,070
Physicochemical properties
- EPA Substance Registry System
- 1 · C.I. Direct Red 1, disodium salt (2429-84-7)
- Symbol(GHS)
- 8 · GHS08,GHS07,GHS09
- Signal word
- Danger
- Hazard statements
- 335 · H335-H302-H410-H319-H350-H315
- Precautionary statements
- 273 · P273-P391-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
- 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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationS - indicates a substance that is identified in a final Significant New Use Rule.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Danger
- Symbol(GHS)
- GHS08,GHS07,GHS09
- Hazard statements
- H335-H302-H410-H319-H350-H315
- Precautionary statements
- P273-P391-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzoic acid, 5-[2-[4'-[2-(2-amino-8-hydroxy-6-sulfo-1-naphthalenyl)diazenyl][1,1'-biphenyl]-4-yl]diazenyl]-2-hydroxy-, sodium salt (1:2): INACTIVE
Preparation methods
Preparation4-(4-Aminophenyl)benzenamine double nitriding, first with 2-Hydroxybenzoic acid coupling, again in acid conditions and 6-Amino-4-hydroxynaphthalene-2-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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