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Substance Name: Cyclohexaneorthocarboxylic acid, cyclic ester with 2-tert-butyl-2-(hydroxymethyl)-1,3-propanediol
RN: 97720-37-1
InChIKey: MYJNSONGYPIOFA-UHFFFAOYSA-N

Molecular Formula

  • C15-H26-O3

Molecular Weight

  • 254.367
 
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Names and Synonyms

Synonyms

  • 1-Cyclohexyl-4-tert-butylbicycloorthocarboxylate
  • 2,6,7-Trioxabicyclo(2.2.2)octane, 1-cyclohexyl-4-(1,1-dimethylethyl)-

Systematic Name

  • Cyclohexaneorthocarboxylic acid, cyclic ester with 2-tert-butyl-2-(hydroxymethyl)-1,3-propanediol

Registry Numbers

CAS Registry Number

  • 97720-37-1

System Generated Number

  • 0097720371

Structure Descriptors

InChI

1S/C15H26O3/c1-13(2,3)14-9-16-15(17-10-14,18-11-14)12-7-5-4-6-8-12/h12H,4-11H2,1-3H3

InChIKey

MYJNSONGYPIOFA-UHFFFAOYSA-N

Smiles

C12(OCC(CO1)(CO2)C(C)(C)C)C1CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 25mg/kg (25mg/kg)   Molecular Pharmacology. Vol. 28, Pg. 246, 1985.