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Substance Name: Vanillyl alcohol
RN: 498-00-0
UNII: X7EA1JUA6M
InChIKey: ZENOXNGFMSCLLL-UHFFFAOYSA-N

Molecular Formula

  • C8-H10-O3

Molecular Weight

  • 154.164
 
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Names and Synonyms

Name of Substance

  • Vanillyl alcohol

Synonyms

  • 4-Hydroxy-3-methoxybenzenemethanol
  • 4-Hydroxy-3-methoxybenzyl alcohol
  • 4-Hydroxy-3-methoxyphenylmethanol
  • AI3-24186
  • Benzenemethanol, 4-hydroxy-3-methoxy-
  • EINECS 207-852-4
  • FEMA No. 3737
  • NSC 3993
  • UNII-X7EA1JUA6M
  • Vanillic alcohol
  • Vanillin alcohol
  • Vanillyl alcohol

Systematic Names

  • 4-Hydroxy-3-methoxybenzenemethanol
  • 4-Hydroxy-3-methoxybenzyl alcohol
  • Benzenemethanol, 4-hydroxy-3-methoxy-

Superlist Name

  • Vanillyl alcohol

Registry Numbers

CAS Registry Number

  • 498-00-0

FDA UNII

  • X7EA1JUA6M

System Generated Number

  • 0000498000

Structure Descriptors

InChI

1S/C8H10O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-4,9-10H,5H2,1H3

InChIKey

ZENOXNGFMSCLLL-UHFFFAOYSA-N

Smiles

c1(cc(ccc1O)CO)OC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 115 deg C   EXP
log P (octanol-water) 0.420 (none)   EST
Water Solubility 2000 mg/L 20 EXP
Atmospheric OH Rate Constant 4.12E-11 cm3/molecule-sec 25 EST

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