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Substance Name: Acetic acid, iodo-, diester with meso-2,3-butanediol
RN: 6305-45-9
InChIKey: GYSXLHFQIXJLIN-OLQVQODUSA-N

Molecular Formula

  • C8-H12-I2-O4

Molecular Weight

  • 425.979
 
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Names and Synonyms

Synonyms

  • meso-2,3-Butanediol-bis(iodoacetate)
  • S 72

Systematic Name

  • Acetic acid, iodo-, diester with meso-2,3-butanediol

Registry Numbers

CAS Registry Number

  • 6305-45-9

Related Registry Number

  • 87-51-4 (Parent)

System Generated Number

  • 0006305459

Structure Descriptors

InChI

1S/C8H12I2O4/c1-5(13-7(11)3-9)6(2)14-8(12)4-10/h5-6H,3-4H2,1-2H3/t5-,6+

InChIKey

GYSXLHFQIXJLIN-OLQVQODUSA-N

Smiles

O([C@H]([C@H](OC(CI)=O)C)C)C(CI)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 22mg/kg (22mg/kg) GASTROINTESTINAL: ULCERATION OR BLEEDING FROM SMALL INTESTINE Journal of the National Cancer Institute. Vol. 31, Pg. 297, 1963.