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Substance Name: Salicylaldehyde
RN: 90-02-8
UNII: 17K64GZH20
InChIKey: SMQUZDBALVYZAC-UHFFFAOYSA-N

Classification Codes

  • Reproductive Effect
  • Skin / Eye Irritant

Molecular Formula

  • C7-H6-O2

Molecular Weight

  • 122.1224
 
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Names and Synonyms

Name of Substance

  • Salicylaldehyde

Synonyms

  • 2-Formylphenol
  • 2-Hydroxybenzaldehyde
  • 4-08-00-00176 (Beilstein Handbook Reference)
  • AI3-02174
  • Benzaldehyde, 2-hydroxy-
  • Benzaldehyde, o-hydroxy-
  • BRN 0471388
  • CCRIS 7451
  • EC 201-961-0
  • EINECS 201-961-0
  • FEMA No. 3004
  • HSDB 721
  • NSC 49178
  • o-Formylphenol
  • o-Hydroxybenzaldehyde
  • SAH
  • Salicyladehyde
  • Salicylal
  • Salicylaldehyde
  • Salicylic aldehyde
  • UNII-17K64GZH20

Systematic Names

  • Benzaldehyde, 2-hydroxy-
  • Salicylaldehyde

Superlist Names

  • o-Hydroxybenzaldehyde
  • Salicylaldehyde

Registry Numbers

CAS Registry Number

  • 90-02-8

FDA UNII

  • 17K64GZH20

Other Registry Number

  • 1563136-87-7

System Generated Number

  • 0000090028

Structure Descriptors

InChI

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

InChIKey

SMQUZDBALVYZAC-UHFFFAOYSA-N

Smiles

c1(c(cccc1)O)C=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 skin 20mL/kg (20mL/kg)   National Technical Information Service. Vol. OTS0533438,
mouse LD50 intraperitoneal 231mg/kg (231mg/kg)   Chemotherapy Vol. 16, Pg. 371, 1971.
mouse LD50 oral 504mg/kg (504mg/kg)   National Technical Information Service. Vol. OTS0533438,
rabbit LD50 skin 3gm/kg (3000mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 903, 1979.
rat LD50 oral 520mg/kg (520mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 903, 1979.
rat LD50 skin 600mg/kg (600mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 903, 1979.
rat LD50 subcutaneous 900mg/kg (900mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 903, 1979.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -7.00E+00 deg C   EXP
Boiling Point 197 deg C   EXP
log P (octanol-water) 1.81 (none)   EXP
Water Solubility 1.70E+04 mg/L 86 EXP
Vapor Pressure 0.593 mm Hg 25 EXP
Henry's Law Constant 5.61E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.80E-11 cm3/molecule-sec 25 EST

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