Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 3-Phenyl-2-propen-1-ol
RN: 104-54-1
InChIKey: OOCCDEMITAIZTP-QPJJXVBHSA-N

Classification Codes

  • Mutation Data
  • Skin / Eye Irritant

Molecular Formula

  • C9-H10-O

Molecular Weight

  • 134.177
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 2-Propen-y1-ol, 3-phenyl-
  • 3-Phenyl-2-propen-1-ol
  • Cinnamyl alcohol

Synonyms

  • 1-06-00-00281 (Beilstein Handbook Reference)
  • 1-Phenylprop-1-en-3-ol
  • 2-Propen-1-ol, 3-phenyl-
  • 3-Fenyl-2-propen-1-ol
  • 3-Fenyl-2-propen-1-ol [Czech]
  • 3-Phenyl-2-propen-1-ol
  • 3-Phenyl-2-propenol
  • 3-Phenylallyl alcohol
  • AI3-00949
  • Alkohol skoricovy
  • Alkohol skoricovy [Czech]
  • BRN 1903999
  • CCRIS 3191
  • Cinnamic alcohol
  • Cinnamic alcohol (natural)
  • Cinnamyl alcohol
  • EC 203-212-3
  • EINECS 203-212-3
  • FEMA No. 2294
  • gamma-Phenylallyl alcohol
  • HSDB 5011
  • NSC 8775
  • Phenyl-2-propen-1-ol
  • Propenoic acid, 3-phenyl-, (trans)-
  • Styrone
  • Styryl alcohol
  • Styryl carbinol
  • Zimtalcohol

Systematic Names

  • 2-Propen-1-ol, 3-phenyl-
  • 3-Phenyl-2-propen-1-ol
  • Cinnamyl alcohol

Superlist Names

  • Cinnamic alcohol
  • Cinnamyl alcohol

Registry Numbers

CAS Registry Number

  • 104-54-1

System Generated Number

  • 0000104541

Structure Descriptors

InChI

1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-7,10H,8H2/b7-4+

InChIKey

OOCCDEMITAIZTP-QPJJXVBHSA-N

Smiles

c1(ccccc1)/C=C/CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 2675mg/kg (2675mg/kg)   Voprosy Pitaniya. Problems of Nutrition. Vol. 33(5), Pg. 48, 1974.
mouse LD50 oral 2675mg/kg (2675mg/kg)   Voprosy Pitaniya. Problems of Nutrition. Vol. 33(5), Pg. 48, 1974.
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 855, 1974.
rat LD50 oral 2gm/kg (2000mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 855, 1974.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 33 deg C   EXP
Boiling Point 250 deg C   EXP
log P (octanol-water) 1.95 (none)   EXP
Water Solubility 6190 mg/L 25 EST
Henry's Law Constant 1.58E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.16E-11 cm3/molecule-sec 25 EST

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