Brilliant Yellow - Dye content ≥50 % , CAS No.3051-11-4

CAS: 3051-11-4 Cat. No.: B294460 Molecular Weight: 624.55 Beilstein Registry Number: 4122338 EC Number: 221-267-1 PubChem CID: 135442944

GRADE & PURITY Dye content ≥50 %

Synonyms

Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-(2-(4-hydroxyphenyl)diazenyl)-, sodium salt (1:2) | Direct Yellow 4 | Paper Yellow 3GX | Paper Yellow CB | B0783 | Benzo Brilliant Yellow | 4,4'-Bis[(4-hydroxyphenyl)azo]stilbene-2,2'-disulfonic acid,sodium

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Benzenesulfonic acid, 2, 2'-(1, 2-ethenediyl)bis(5-(2-(4-hydroxyphenyl)diazenyl)-, sodium salt (1:2) | Direct Yellow 4 | Paper Yellow 3GX | Paper Yellow CB | B0783 | Benzo Brilliant Yellow | 4, 4'-Bis[(4-hydroxyphenyl)azo]stilbene-2, 2'-disulfonic acid, sodium

Specifications & Purity

Dye content ≥50 %

Storage

Room temperature

Shipped In

Normal

Names and Identifiers

• Canonical Smiles: C1=CC(=CC=C1N=NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]
• IUPAC Name: disodium;5-[(4-hydroxyphenyl)diazenyl]-2-[(E)-2-[4-[(4-hydroxyphenyl)diazenyl]-2-sulfonatophenyl]ethenyl]benzenesulfonate
• InChIKey: YLDIUICHQPKMNH-ZFEDVODKSA-L
• INCHI: 1S/C26H20N4O8S2.2Na/c31-23-11-7-19(8-12-23)27-29-21-5-3-17(25(15-21)39(33,34)35)1-2-18-4-6-22(16-26(18)40(36,37)38)30-28-20-9-13-24(32)14-10-20;;/h1-16,31-32H,(H,33,34,35)(H,36,37,38);;/q;2*+1/p-2/b2-1+,29-27?,30-28?
• Isomeric SMILES: C1=CC(=CC=C1N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N=NC4=CC=C(C=C4)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]
• WGK Germany: 3
• PubChem CID: 135442944
• Molecular Weight: 624.55
• Beilstein: 4122338
• Reaxy-Rn: 6952957

Chemical and Physical Properties

• Molecular Weight: 624.600 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 6
• Exact Mass: 624.036 Da
• Monoisotopic Mass: 624.036 Da
• Topological Polar Surface Area: 221.000 Ų
• Heavy Atom Count: 42
• Formal Charge: 0
• Complexity: 1000.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 3

XLogP3

References

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