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Substance Name: Isoamyl phenethyl ether
RN: 56011-02-0
UNII: X768037VTG
InChIKey: BHQBQWOZHYUVTL-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C13-H20-O

Molecular Weight

  • 192.3
 
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Names and Synonyms

Name of Substance

  • Isoamyl phenethyl ether

Synonyms

  • (2-(3-Methylbutoxy)ethyl)benzene
  • 2-Phenylethyl isopentyl ether
  • Anther
  • Benzene, (2-(3-methylbutoxy)ethyl)-
  • BRN 2250579
  • EINECS 259-943-3
  • Isoamyl phenylethyl ether
  • Phenylethyl isoamyl ether
  • UNII-X768037VTG

Systematic Names

  • Benzene, (2-(3-methylbutoxy)ethyl)-
  • Isopentyl phenethyl ether

Registry Numbers

CAS Registry Number

  • 56011-02-0

FDA UNII

  • X768037VTG

Other Registry Number

  • 54173-86-3

System Generated Number

  • 0056011020

Structure Descriptors

InChI

1S/C13H20O/c1-12(2)8-10-14-11-9-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3

InChIKey

BHQBQWOZHYUVTL-UHFFFAOYSA-N

Smiles

O(CCc1ccccc1)CCC(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 21, Pg. 873, 1983.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 21, Pg. 873, 1983.