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Substance Name: 1,3-Propanediol, 2-ethyl-2-propyl-, cyclic sulfite (ester)
RN: 3670-87-9
InChIKey: UAESTUNADZQSIS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H16-O3-S

Molecular Weight

  • 192.277
 
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Names and Synonyms

Synonyms

  • 1,3,2-Dioxathiane, 5-ethyl-5-propyl-, 2-oxide
  • 2-Ethyl-2-propyl-1,3-propanediol cyclic sulfite (ester)

Systematic Name

  • 1,3-Propanediol, 2-ethyl-2-propyl-, cyclic sulfite (ester)

Registry Numbers

CAS Registry Number

  • 3670-87-9

System Generated Number

  • 0003670879

Structure Descriptors

InChI

1S/C8H16O3S/c1-3-5-8(4-2)6-10-12(9)11-7-8/h3-7H2,1-2H3

InChIKey

UAESTUNADZQSIS-UHFFFAOYSA-N

Smiles

O1S(OCC(C1)(CCC)CC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 310mg/kg (310mg/kg)   Experientia. Vol. 22, Pg. 15, 1966.