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Fluorescent Brightener 134 (Technical Grade)

CAT: 0572-TRC-F597825-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-F597825-100MGSize:100 mg
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CAS Number
3426-43-5
Synonyms
Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis[5-[[4-methoxy-6-(phenylamino)-1,3,5-triazin-2-yl]amino]-, sodium salt (1:2); 2,2’-Stilbenedisulfonic acid, 4,4'-bis[(4-anilino-6-methoxy-s-triazin-2-yl)amino]-, disodium salt (6CI,7CI,8CI); Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis[5-[[4-methoxy-6-(phenylamino)-1,3,5-triazin-2-yl]amino]-, disodium salt (9CI); Belofor KB; C.I. 40619; C.I. FBA 90; C.I. Fluorescent Brightener 134; C.I. Fluorescent Brightener 213; C.I. Fluorescent Brightener 90; C.I. Fluorescent Brightening Agent 90; CF; Disodium 4,4'-bis(2-methoxy-4-phenylamino-s-triazin-6-ylamino)stilbine-2,2'-disulfonate; Disodium 4,4'-bis[(2-anilino-4-methoxy-1,3,5-triazin-6-yl)amino]stilbene-2,2'-disulfonate; Fluorescent Brightener 213; Fluorescent Brightening Agent 90; Heliofor CSP; Heliofor RCP; Intrawite CF; Kayaphor AS; Kayaphor AS 150; Kayaphor ASC; Leucophor PC; Mikephor BS; Photine HV; Ranipal NYR; Rylux PRS; Uvitex CF; Uvitex CF 200; Uvitex CF conc. PRS; Whitex BF; Whitex BOF; Whitex HP
Hazard Statement
No Data Available
Smiles
[Na+].[Na+].COc1nc(Nc2ccccc2)nc(Nc3ccc(C=Cc4ccc(Nc5nc(Nc6ccccc6)nc(OC)n5)cc4S(=O)(=O)[O-])c(c3)S(=O)(=O)[O-])n1
Molecular Formula
C34H28N10Na2O8S2
Molecular Weight
814.76
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Disodium 4,4'-bis((4-anilino-6-methoxy-1,3,5-triazin-2-yl)amino)stilbene-2,2'-disulphonate

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CAS Number3426-43-5
PubChem CID6444191
IUPAC Namedisodium;5-[(4-anilino-6-methoxy-1,3,5-triazin-2-yl)amino]-2-[(E)-2-[4-[(4-anilino-6-methoxy-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl]ethenyl]benzenesulfonate
Molecular FormulaC34H28N10Na2O8S2
Molecular Weight814.8
Topological Polar Surface Area275
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count18
Rotatable Bond Count12
Heavy Atom Count56
Formal Charge0
Complexity1280
SMILES
COC1=NC(=NC(=N1)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)OC)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=CC=CC=C6.[Na+].[Na+]
InChI
InChI=1S/C34H30N10O8S2.2Na/c1-51-33-41-29(35-23-9-5-3-6-10-23)39-31(43-33)37-25-17-15-21(27(19-25)53(45,46)47)13-14-22-16-18-26(20-28(22)54(48,49)50)38-32-40-30(42-34(44-32)52-2)36-24-11-7-4-8-12-24;;/h3-20H,1-2H3,(H,45,46,47)(H,48,49,50)(H2,35,37,39,41,43)(H2,36,38,40,42,44);;/q;2*+1/p-2/b14-13+;;
InChIKey
BDYOOAPDMVGPIQ-QDBORUFSSA-L
Chemical Structure
2D Structure
2D structure of Disodium 4,4'-bis((4-anilino-6-methoxy-1,3,5-triazin-2-yl)amino)stilbene-2,2'-disulphonate
CAS: 3426-43-5
CID: 6444191
Formula: C34H28N10Na2O8S2
MW: 814.8
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight814.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count18
Rotatable Bond Count12
Exact Mass814.13283880
Monoisotopic Mass814.13283880
Topological Polar Surface Area275 Ų
Heavy Atom Count56
Formal Charge0
Complexity1280
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes