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Substance Name: 1-Ethyl-1-methyl-3-phenylpropyl acetate
RN: 72007-81-9
UNII: OX1DN3B7LS
InChIKey: HIWRBTFSEFIZNE-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C14-H20-O2

Molecular Weight

  • 220.31
 
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Names and Synonyms

Name of Substance

  • 1-Ethyl-1-methyl-3-phenylpropyl acetate

Synonyms

  • 1-Ethyl-1-methyl-3-phenylpropyl acetate
  • 1-Phenyl-3-methyl-3-pentanyl acetate
  • 4-06-00-03420 (Beilstein Handbook Reference)
  • alpha-Ethyl-alpha-methylbenzenepropanol acetate
  • BRN 3260573
  • EINECS 276-282-6
  • Methylethyl phenylethyl carbinyl acetate
  • Phenethylmethylethylcarbinyl acetate
  • Phenylethyl methylethyl carbinyl acetate
  • Phenylethyl methylethylcarbinyl acetate
  • UNII-OX1DN3B7LS

Systematic Names

  • 1-Ethyl-1-methyl-3-phenylpropyl acetate
  • 3-Pentanol, 3-methyl-1-phenyl-, acetate
  • Benzenepropanol, alpha-ethyl-alpha-methyl-, 1-acetate
  • Benzenepropanol, alpha-ethyl-alpha-methyl-, acetate

Registry Numbers

CAS Registry Number

  • 72007-81-9

FDA UNII

  • OX1DN3B7LS

System Generated Number

  • 0072007819

Structure Descriptors

InChI

InChI=1S/C14H20O2/c1-4-14(3,16-12(2)15)11-10-13-8-6-5-7-9-13/h5-9H,4,10-11H2,1-3H3

InChIKey

HIWRBTFSEFIZNE-UHFFFAOYSA-N

Smiles

CCC(C)(CCc1ccccc1)OC(=O)C