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Home> Hot Product Listed S   > sodium 4-[[4-[(4-ethoxyphenyl)azo]-2,5-dimethoxyphenyl]azo]benzenesulphonate
68937-66-6 structure

sodium 4-[[4-[(4-ethoxyphenyl)azo]-2,5-dimethoxyphenyl]azo]benzenesulphonate

Iupac Name:1-ethoxyhexane;1-propoxyhexane
CAS No.:68937-66-6
Molecular Weight:274.489
Molecular Formula:C13H12BRF3O3S (isomer)
Names and Identifiers
Synonyms

4-((4-(4-Ethoxyphenylazo)-2,5-dimethoxyphenyl)azo)benzenesulfonic acid, sodium salt 4-[[4-[(4-ethoxyphenyl)azo]-2,5-dimethoxyphenyl]azo]benzenesulfonic acid sodium salt AC1Q1VH9 benzenesulfonic acid, 4-((4-(4-ethoxyphenylazo)-2,5-dimethoxyphenyl)azo)-, sodium salt Benzenesulfonic acid, 4-(2-(4-(2-(4-ethoxyphenyl)diazenyl)-2,5-dimethoxyphenyl)diazenyl)-, sodium salt (1:1) Benzenesulfonic acid, 4-[[4-[(4-ethoxyphenyl)azo] -2,5-dimethoxyphenyl]azo]-, sodium salt benzenesulfonic acid, 4-[[4-[(4-ethoxyphenyl)azo]-2,5-dimethoxyphenyl]azo]-, sodium salt benzenesulfonic acid, 4-[2-[4-[2-(4-ethoxyphenyl)diazenyl]-2,5-dimethoxyphenyl]diazenyl]-, sodium salt (1:1) DTXSID9070747 Einecs 267-517-3 OR075115 sodium 4-(2-{4-[2-(4-ethoxyphenyl)diazen-1-yl]-2,5-dimethoxyphenyl}diazen-1-yl)benzenesulfonate sodium 4-[(e)-{4-[(e)-(4-ethoxyphenyl)diazenyl]-2,5-dimethoxyphenyl}diazenyl]benzenesulfonate

Inchi
InChI=1S/C9H20O.C8H18O/c1-3-5-6-7-9-10-8-4-2;1-3-5-6-7-8-9-4-2/h3-9H2,1-2H3;3-8H2,1-2H3
InChkey
QTUGCFPIWBMXQE-UHFFFAOYSA-N
Canonical Smiles
CCCCCCOCC.CCCCCCOCCC
Safety and Handling
PackingGroup
III
Transport
3082
Computational chemical data
  • Molecular Weight:274.489g/mol
  • Molecular Formula:C13H12BRF3O3S
  • Compound Is Canonicalized:True
  • Exact Mass:274.287
  • Monoisotopic Mass:274.287
  • Complexity:96.5
  • Rotatable Bond Count:13
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:18.5A^2
  • Heavy Atom Count:19
  • 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:2
  • CACTVS Substructure Key Fingerprint: AAADcfB4MAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAAAAAACACggAICAAAABAAA AAAAAAAAAAAAAAAAAAAAAAAAAAIAAAACAAAEAAAAAAGAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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