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Substance Name: 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-
RN: 67633-94-7
InChIKey: KSEFBQCEGMTNPD-UHFFFAOYSA-N

Molecular Formula

  • C14-H20-O2

Molecular Weight

  • 220.31
 
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Names and Synonyms

Synonyms

  • 2-(Phenylmethyl)-4,4,6-trimethyl-1,3-dioxane
  • 4,4,6-Trimethyl-2-benzyl-1,3-dioxane
  • 4-19-00-00250 (Beilstein Handbook Reference)
  • BRN 0134216
  • EINECS 266-795-3
  • m-Dioxane, 2-benzyl-4,4,6-trimethyl-
  • NSC 26387
  • Phenylacetaldehyde 2,4-dihydroxy-2-methylpentane acetal
  • Reseda body

Systematic Names

  • 1,3-Dioxane, 2-(phenylmethyl)-4,4,6-trimethyl-
  • 1,3-Dioxane, 4,4,6-trimethyl-2-(phenylmethyl)-
  • 2-Benzyl-4,4,6-trimethyl-1,3-dioxane

Registry Numbers

CAS Registry Number

  • 67633-94-7

System Generated Number

  • 0067633947

Structure Descriptors

InChI

InChI=1S/C14H20O2/c1-11-10-14(2,3)16-13(15-11)9-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3

InChIKey

KSEFBQCEGMTNPD-UHFFFAOYSA-N

Smiles

CC1CC(C)(C)OC(Cc2ccccc2)O1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 103S, 1992.
rat LDLo oral 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 103S, 1992.