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Substance Name: Phenyl allyl ether
RN: 1746-13-0
UNII: 26S07OSX4O
InChIKey: POSICDHOUBKJKP-UHFFFAOYSA-N

Molecular Formula

  • C9-H10-O

Molecular Weight

  • 134.177
 
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Names and Synonyms

Name of Substance

  • Phenyl allyl ether

Synonyms

  • 3-Phenoxypropene
  • 4-06-00-00562 (Beilstein Handbook Reference)
  • AI3-03143
  • Allyl phenoxylate
  • Allyl phenyl ether
  • Allyloxybenzene
  • BRN 1905622
  • EINECS 217-125-3
  • Ether, allyl phenyl
  • NSC 4746
  • Phenyl 2-propenyl ether
  • Phenyl allyl ether
  • Phenylpropenyl ether
  • UNII-26S07OSX4O
  • USAF DO-23

Systematic Names

  • Allyl phenyl ether
  • Benzene, (2-propen-1-yloxy)-
  • Benzene, (2-propenyloxy)-
  • Ether, allyl phenyl (8CI)

Registry Numbers

CAS Registry Number

  • 1746-13-0

FDA UNII

  • 26S07OSX4O

System Generated Number

  • 0001746130

Structure Descriptors

InChI

1S/C9H10O/c1-2-8-10-9-6-4-3-5-7-9/h2-7H,1,8H2

InChIKey

POSICDHOUBKJKP-UHFFFAOYSA-N

Smiles

O(c1ccccc1)CC=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   National Technical Information Service. Vol. AD277-689,
mouse LD50 intravenous 63mg/kg (63mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01855,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 191.7 deg C   EXP
log P (octanol-water) 2.94 (none)   EXP
Water Solubility 273 mg/L 25 EST
Vapor Pressure 0.591 mm Hg 25 EST
Henry's Law Constant 4.18E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.35E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.