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Substance Name: Benzoic acid, 3,5-bis(bromomethyl)-, 2-(dimethylamino)ethyl ester
ID: DG43980000
InChIKey: WIKQECFXECYNID-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C13-H17-Br2-N-O2

Molecular Weight

  • 379.0903
 
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Names and Synonyms

Synonyms

  • 3,5-Bis(bromomethyl)benzoic acid 2-(dimethylamino)ethyl ester
  • 3,5-Dibromomethylbenzoyl dimethylaminoethanol

Systematic Name

  • Benzoic acid, 3,5-bis(bromomethyl)-, 2-(dimethylamino)ethyl ester

Registry Numbers

ID Number

  • NIOSH/DG4398000

System Generated Number

  • DG43980000

Structure Descriptors

InChI

1S/C13H17Br2NO2/c1-16(2)3-4-18-13(17)12-6-10(8-14)5-11(7-12)9-15/h5-7H,3-4,8-9H2,1-2H3

InChIKey

WIKQECFXECYNID-UHFFFAOYSA-N

Smiles

CN(C)CCOC(=O)c1cc(CBr)cc(CBr)c1