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Substance Name: alpha-Chlorohydrin-bis(3-nitrobenzoate)
RN: 75645-14-6
InChIKey: KJOBVSGFGZSCKJ-UHFFFAOYSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C17-H13-Cl-N2-O8

Molecular Weight

  • 408.749
 
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Names and Synonyms

Name of Substance

  • alpha-Chlorohydrin-bis(3-nitrobenzoate)

Synonym

  • alpha-Chlorohydrin bis(m-nitrobenzoate)

Systematic Name

  • 1,2-Propanediol, 3-chloro-, bis(3-nitrobenzoate)

Registry Numbers

CAS Registry Number

  • 75645-14-6

System Generated Number

  • 0075645146

Structure Descriptors

InChI

1S/C17H13ClN2O8/c18-9-15(28-17(22)12-4-2-6-14(8-12)20(25)26)10-27-16(21)11-3-1-5-13(7-11)19(23)24/h1-8,15H,9-10H2

InChIKey

KJOBVSGFGZSCKJ-UHFFFAOYSA-N

Smiles

C([C@@H](CCl)OC(c1cc(ccc1)[N+](=O)[O-])=O)OC(c1cc(ccc1)[N+](=O)[O-])=O