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Substance Name: CB 10252
RN: 39669-49-3
UNII: 5MXL56V9K8
InChIKey: IUBPTOPNFAZJQA-WCWDXBQESA-N

Molecular Formula

  • C20-H23-Br2-N3-O2

Molecular Weight

  • 497.229
 
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Names and Synonyms

Name of Substance

  • CB 10252

Synonyms

  • Azobenzene, 4-bis(2-bromopropyl)amino-2'-carboxy-2-methyl-
  • Benzoic acid, 2-(4-bis(2-bromopropyl)amino-1-(o-tolyl))azo-
  • EINECS 254-583-3
  • UNII-5MXL56V9K8

Systematic Names

  • 2-((4-(Bis(2-bromopropyl)amino)-2-tolyl)azo)benzoic acid
  • Benzoic acid, 2-(4-bis(2-bromopropyl)amino-2-methyl)phenylazo-

Registry Numbers

CAS Registry Number

  • 39669-49-3

FDA UNII

  • 5MXL56V9K8

System Generated Number

  • 0039669493

Structure Descriptors

InChI

1S/C20H23Br2N3O2/c1-13-10-16(25(11-14(2)21)12-15(3)22)8-9-18(13)23-24-19-7-5-4-6-17(19)20(26)27/h4-10,14-15H,11-12H2,1-3H3,(H,26,27)/b24-23+

InChIKey

IUBPTOPNFAZJQA-WCWDXBQESA-N

Smiles

c1(N(C[C@@H](C)Br)C[C@@H](C)Br)cc(c(\N=N\c2c(cccc2)C(O)=O)cc1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 23mg/kg (23mg/kg)   Journal of the National Cancer Institute. Vol. 50, Pg. 243, 1973.