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Substance Name: Heptanal propyleneglycol acetal
RN: 4351-10-4
UNII: XZS283GZWC
InChIKey: GFNFPBSXMBRHRU-UHFFFAOYSA-N

Molecular Formula

  • C10-H20-O2

Molecular Weight

  • 172.266
 
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Names and Synonyms

Name of Substance

  • Heptanal propyleneglycol acetal

Synonyms

  • 2-Hexyl-4-methyl-1,3-dioxolan
  • 2-Hexyl-4-methyl-1,3-dioxolane
  • 4-19-00-00099 (Beilstein Handbook Reference)
  • AI3-05026
  • BRN 0105323
  • EINECS 224-413-2
  • Heptanal, cyclic propylene acetal
  • NSC 406654
  • NSC 6566
  • UNII-XZS283GZWC

Systematic Names

  • 1,3-Dioxolane, 2-hexyl-4-methyl-
  • 2-Hexyl-4-methyl-1,3-dioxolane

Registry Numbers

CAS Registry Number

  • 4351-10-4

FDA UNII

  • XZS283GZWC

System Generated Number

  • 0004351104

Structure Descriptors

InChI

1S/C10H20O2/c1-3-4-5-6-7-10-11-8-9(2)12-10/h9-10H,3-8H2,1-2H3

InChIKey

GFNFPBSXMBRHRU-UHFFFAOYSA-N

Smiles

O1[C@@H](OC[C@@H]1C)CCCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 500mg/kg (500mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 8, Pg. 742, 1956.