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Substance Name: 1,10-Decanediol, 2,9-dimethyl-2,9-dipropyl-
RN: 85018-64-0
InChIKey: JEFKIPKXHPCULJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H38-O2

Molecular Weight

  • 286.4962
 
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Names and Synonyms

Synonym

  • 2,9-Dimethyl-2,9-dipropyl-1,10-decanediol

Systematic Name

  • 1,10-Decanediol, 2,9-dimethyl-2,9-dipropyl-

Registry Numbers

CAS Registry Number

  • 85018-64-0

System Generated Number

  • 0085018640

Structure Descriptors

InChI

1S/C18H38O2/c1-5-11-17(3,15-19)13-9-7-8-10-14-18(4,16-20)12-6-2/h19-20H,5-16H2,1-4H3

InChIKey

JEFKIPKXHPCULJ-UHFFFAOYSA-N

Smiles

CCCC(C)(CCCCCCC(C)(CCC)CO)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   European Patent Application. Vol. #0064286,
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0064286,