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Substance Name: Undecanoic acid, 11-isopropylthio-
RN: 102613-00-3
InChIKey: PKEPWUXLPFTMSN-UHFFFAOYSA-N

Molecular Formula

  • C14-H28-O2-S

Molecular Weight

  • 260.4392
 
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Names and Synonyms

Synonyms

  • 11-Isopropylthioundecanoic acid
  • Hendecanoic acid, 11-isopropylthio-

Systematic Name

  • Undecanoic acid, 11-isopropylthio-

Registry Numbers

CAS Registry Number

  • 102613-00-3

System Generated Number

  • 0102613003

Structure Descriptors

InChI

1S/C14H28O2S/c1-13(2)17-12-10-8-6-4-3-5-7-9-11-14(15)16/h13H,3-12H2,1-2H3,(H,15,16)

InChIKey

PKEPWUXLPFTMSN-UHFFFAOYSA-N

Smiles

C(=O)(O)CCCCCCCCCCSC(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08152,