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Substance Name: 3-Hydroxybenzaldehyde
RN: 100-83-4
UNII: 8Z2819J40E
InChIKey: IAVREABSGIHHMO-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C7-H6-O2

Molecular Weight

  • 122.1224
 
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Names and Synonyms

Name of Substance

  • 3-Hydroxybenzaldehyde

Synonyms

  • 3-Formylphenol
  • 3-Hydroxybenzaldehyde
  • 4-08-00-00240 (Beilstein Handbook Reference)
  • AI3-12120
  • BRN 0507099
  • EC 202-892-9
  • EINECS 202-892-9
  • m-Formylphenol
  • m-Hydroxybenzaldehyde
  • meta-Hydroxybenzaldehyde
  • NSC 3504
  • UNII-8Z2819J40E

Systematic Names

  • 3-Hydroxybenzaldehyde
  • Benzaldehyde, 3-hydroxy-
  • Benzaldehyde, m-hydroxy-

Registry Numbers

CAS Registry Number

  • 100-83-4

FDA UNII

  • 8Z2819J40E

System Generated Number

  • 0000100834

Structure Descriptors

InChI

1S/C7H6O2/c8-5-6-2-1-3-7(9)4-6/h1-5,9H

InChIKey

IAVREABSGIHHMO-UHFFFAOYSA-N

Smiles

Oc1cccc(C=O)c1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 108 deg C   EXP
Boiling Point 240 deg C   EXP
pKa Dissociation Constant 8.98 (none) 25 EXP
log P (octanol-water) 1.29 (none)   EXP
Water Solubility 7190 mg/L 25 EXP
Vapor Pressure 0.014 mm Hg 25 EST
Henry's Law Constant 2.50E-09 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 3.39E-11 cm3/molecule-sec 25 EST

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