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Substance Name: 1,12-Dodecanediol, 2,2,11,11-tetramethyl-
RN: 5658-47-9
InChIKey: QXDHBNHGLUNWRI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H34-O2

Molecular Weight

  • 258.443
 
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Names and Synonyms

Synonym

  • 2,2,11,11-Tetramethyl-1,12-dodecanediol

Systematic Name

  • 1,12-Dodecanediol, 2,2,11,11-tetramethyl-

Registry Numbers

CAS Registry Number

  • 5658-47-9

System Generated Number

  • 0005658479

Structure Descriptors

InChI

1S/C16H34O2/c1-15(2,13-17)11-9-7-5-6-8-10-12-16(3,4)14-18/h17-18H,5-14H2,1-4H3

InChIKey

QXDHBNHGLUNWRI-UHFFFAOYSA-N

Smiles

C(C(CCCCCCCCC(CO)(C)C)(C)C)O

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,