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Substance Name: Benzoic acid, 2-(4-(bis(2-(methylsulfonyloxy)ethyl))amino)phenylazo-
RN: 40136-84-3
InChIKey: VFDIQCPKTDCVOZ-QZQOTICOSA-N

Molecular Formula

  • C19-H23-N3-O8-S2

Molecular Weight

  • 485.536
 
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Names and Synonyms

Synonyms

  • Azobenzene, 4-bis(2-(methylsulfonyloxy)ethyl)amino-2'-carboxy-
  • NSC 240597

Systematic Name

  • Benzoic acid, 2-(4-(bis(2-(methylsulfonyloxy)ethyl))amino)phenylazo-

Registry Numbers

CAS Registry Number

  • 40136-84-3

System Generated Number

  • 0040136843

Structure Descriptors

InChI

1S/C19H23N3O8S2/c1-31(25,26)29-13-11-22(12-14-30-32(2,27)28)16-9-7-15(8-10-16)20-21-18-6-4-3-5-17(18)19(23)24/h3-10H,11-14H2,1-2H3,(H,23,24)/b21-20+

InChIKey

VFDIQCPKTDCVOZ-QZQOTICOSA-N

Smiles

c1(N(CCOS(C)(=O)=O)CCOS(C)(=O)=O)ccc(\N=N\c2c(cccc2)C(O)=O)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 25mg/kg (25mg/kg)   Journal of the National Cancer Institute. Vol. 50, Pg. 243, 1973.