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Home> Hot Product Listed P   > pentasodium 5-[[3-[[[4-[[4-[[8-[(3-aminobenzoyl)amino]-1-hydroxy-3,6-disulphonato-2-naphthyl]azo]-3-...
7439-90-9 structure

pentasodium 5-[[3-[[[4-[[4-[[8-[(3-aminobenzoyl)amino]-1-hydroxy-3,6-disulphonato-2-naphthyl]azo]-3-methoxy-7-sulphonato-1-naphthyl]azo]-3-sulphonatophenyl]amino]carbonyl]phenyl]azo]salicylate

Iupac Name:krypton
CAS No.:7439-90-9
EINECS(EC#): 274-391-3
Molecular Weight:83.798
Molecular Formula:C22H16N3NAO7S2 (isomer)
Names and Identifiers
Synonyms

Benzoic acid, 5-((3-(((4-((4-((8-((3-aminobenzoyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-3-methoxy-7-sulfo-1-naphthalenyl)azo)-3-sulfophenyl)amino)carbonyl)phenyl)azo)-2-hydroxy-, pentasodium salt Benzoic acid, 5-((3-(((4-((4-((8-((3-aminobenzoyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-3-methoxy-7-sulfo-1-naphthalenyl)azo-3-sulfophenyl)amino)carbonyl)phenyl)azo)-2-hydroxy-, pentasodium salt Benzoic acid, 5-(2-(3-(((4-(2-(4-(2-(8-((3-aminobenzoyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-3-methoxy-7-sulfo-1-naphthalenyl)diazenyl)-3-sulfophenyl)amino)carbonyl)phenyl)diazenyl)-2-hydroxy-, sodium salt (1:5) Einecs 274-389-2 Pentasodium 5-((3-(((4-((4-((8-((3-aminobenzoyl)amino)-1-hydroxy-3,6-disulphonato-2-naphthyl)azo)-3-methoxy-7-sulphonato-1-naphthyl)azo)-3-sulphonatophenyl)amino)carbonyl)phenyl)azo)salicylate

Inchi
InChI=1S/Kr
InChkey
DNNSSWSSYDEUBZ-UHFFFAOYSA-N
Canonical Smiles
[Kr]
Properties
Melting Point
-157ºC
Safety and Handling
Risk Statements
R9
Safety Statements
9-38
HazardClass
2.2
Transport
UN 1950 2
Reach Info
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Gases under pressure: Compressed gas

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H280 Contains gas under pressure; may explode if heated

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:83.798g/mol
  • Molecular Formula:C22H16N3NAO7S2
  • Compound Is Canonicalized:True
  • Exact Mass:83.911
  • Monoisotopic Mass:83.911
  • Complexity:0
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0A^2
  • Heavy Atom Count:1
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADcQAAAAAAAAAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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