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Substance Name: 1,6-Dioxaspiro(4.4)nonane
RN: 176-25-0
InChIKey: YVSCOIUNVKGTND-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H12-O2

Molecular Weight

  • 128.17
 
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Names and Synonyms

Synonym

  • AI3-19473

Systematic Name

  • 1,6-Dioxaspiro(4.4)nonane

Registry Numbers

CAS Registry Number

  • 176-25-0

System Generated Number

  • 0000176250

Structure Descriptors

InChI

1S/C7H12O2/c1-3-7(8-5-1)4-2-6-9-7/h1-6H2

InChIKey

YVSCOIUNVKGTND-UHFFFAOYSA-N

Smiles

O1CCCC21OCCC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 500mg/kg (500mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 6, Pg. 219, 1954.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.140 (none)   EST
Water Solubility 1.00E+05 mg/L   EXP
Atmospheric OH Rate Constant 1.93E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.