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Substance Name: Coniferyl alcohol
RN: 458-35-5
InChIKey: JMFRWRFFLBVWSI-IHWYPQMZSA-N

Molecular Formula

  • C10-H12-O3

Molecular Weight

  • 180.202
 
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Names and Synonyms

Name of Substance

  • Coniferyl alcohol

Synonyms

  • AI3-36149
  • EINECS 207-277-9

Systematic Names

  • 3-(4-Hydroxy-3-methoxyphenyl)-2-propen-1-ol
  • 4-Hydroxy-3-methoxycinnamylic alcohol
  • Phenol, 4-(3-hydroxy-1-propen-1-yl)-2-methoxy-
  • Phenol, 4-(3-hydroxy-1-propenyl)-2-methoxy-

Registry Numbers

CAS Registry Number

  • 458-35-5

System Generated Number

  • 0000458355

Structure Descriptors

InChI

1S/C10H12O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-5,7,11-12H,6H2,1H3/b3-2-

InChIKey

JMFRWRFFLBVWSI-IHWYPQMZSA-N

Smiles

c1(cc(c(O)cc1)OC)\C=C/CO

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 74 deg C   EXP
log P (octanol-water) 1.190 (none)   EST
Water Solubility 1.65E+04 mg/L 25 EST
Vapor Pressure 8.80E-06 mm Hg 25 EST
Henry's Law Constant 8.68E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.79E-11 cm3/molecule-sec 25 EST

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