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Substance Name: Propyl salicylate
RN: 607-90-9
UNII: 8CP40IDZ6D
InChIKey: LZFIOSVZIQOVFW-UHFFFAOYSA-N

Molecular Formula

  • C10-H12-O3

Molecular Weight

  • 180.2018
 
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Names and Synonyms

Name of Substance

  • Propyl salicylate

Synonyms

  • AI3-23185
  • EINECS 210-145-3
  • NSC 8221
  • Propyl o-hydroxybenzoate
  • Propyl salicylate
  • UNII-8CP40IDZ6D

Systematic Names

  • Benzoic acid, 2-hydroxy-, propyl ester
  • Propyl salicylate
  • Salicylic acid, propyl ester (8CI)

Registry Numbers

CAS Registry Number

  • 607-90-9

FDA UNII

  • 8CP40IDZ6D

System Generated Number

  • 0000607909

Structure Descriptors

InChI

InChI=1S/C10H12O3/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h3-6,11H,2,7H2,1H3

InChIKey

LZFIOSVZIQOVFW-UHFFFAOYSA-N

Smiles

CCCOC(=O)c1ccccc1O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 97 deg C   EXP
Boiling Point 239 deg C   EXP
log P (octanol-water) 3.8 (none)   EXP
Water Solubility 119 mg/L 25 EST
Vapor Pressure 5.55E-04 mm Hg 25 EST
Henry's Law Constant 8.01E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.41E-11 cm3/molecule-sec 25 EST

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