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Substance Name: Benzenemethanol, 2,4-dimethyl-, 1-acetate
RN: 62346-96-7
InChIKey: IRJIWPLWQGRUAY-UHFFFAOYSA-N

Molecular Formula

  • C11-H14-O2

Molecular Weight

  • 178.23
 
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Names and Synonyms

Synonyms

  • 2,4-Dimethylbenzenemethanol acetate
  • 2,4-Dimethylbenzyl acetate
  • 4-06-00-03250 (Beilstein Handbook Reference)
  • AI3-21160
  • Benzyl alcohol, 2,4-dimethyl-, acetate
  • BRN 2503845
  • EINECS 263-518-8

Systematic Names

  • 2,4-Dimethylbenzyl acetate
  • Benzenemethanol, 2,4-dimethyl-, 1-acetate
  • Benzenemethanol, 2,4-dimethyl-, acetate

Registry Numbers

CAS Registry Number

  • 62346-96-7

System Generated Number

  • 0062346967

Structure Descriptors

InChI

1S/C11H14O2/c1-8-4-5-11(9(2)6-8)7-13-10(3)12/h4-6H,7H2,1-3H3

InChIKey

IRJIWPLWQGRUAY-UHFFFAOYSA-N

Smiles

O=C(OCc1c(cc(cc1)C)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 21S, 1992.
mouse LDLo oral 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 21S, 1992.