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Substance Name: 2,2'-Stilbenedisulfonic acid, 4,4'-bis((4-(2-methoxyethoxy)-6-(N-methyl-N-2-sulfoethyl)amino-s-triazin-2-yl)amino)-
RN: 60397-73-1
InChIKey: CGYZCRWUXPGWAH-AATRIKPKSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C32-H42-N10-O16-S4

Molecular Weight

  • 951.0018
 
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Names and Synonyms

  • 2,2'-Stilbenedisulfonic acid, 4,4'-bis((4-(2-methoxyethoxy)-6-(N-methyl-N-2-sulfoethyl)amino-s-triazin-2-yl)amino)-
  • Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-(2-methoxyethoxy)-6-(methyl(2-sulfoethyl)amino)-1,3,5-triazin-2-yl)amino)-

Registry Numbers

CAS Registry Number

  • 60397-73-1

System Generated Number

  • 0060397731

Structure Descriptors

InChI

1S/C32H42N10O16S4/c1-41(11-17-59(43,44)45)29-35-27(37-31(39-29)57-15-13-55-3)33-23-9-7-21(25(19-23)61(49,50)51)5-6-22-8-10-24(20-26(22)62(52,53)54)34-28-36-30(42(2)12-18-60(46,47)48)40-32(38-28)58-16-14-56-4/h5-10,19-20H,11-18H2,1-4H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,33,35,37,39)(H,34,36,38,40)/b6-5+

InChIKey

CGYZCRWUXPGWAH-AATRIKPKSA-N

Smiles

CN(CCS(=O)(=O)O)c1nc(nc(n1)OCCOC)Nc2ccc(c(c2)S(=O)(=O)O)/C=C/c3ccc(cc3S(=O)(=O)O)Nc4nc(nc(n4)OCCOC)N(C)CCS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 15gm/kg (15000mg/kg)   MVC-Report. Vol. 2, Pg. 193, 1973.