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Substance Name: Phloroglucinol dimethyl ether
RN: 500-99-2
UNII: 23UXW8136A
InChIKey: XQDNFAMOIPNVES-UHFFFAOYSA-N

Molecular Formula

  • C8-H10-O3

Molecular Weight

  • 154.164
 
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Names and Synonyms

Name of Substance

  • Phloroglucinol dimethyl ether

Synonyms

  • 1-Hydroxy-3,5-dimethoxybenzene
  • EINECS 207-917-7
  • NSC 70955
  • Phloroglucinol dimethyl ether
  • Taxicatigenin
  • UNII-23UXW8136A

Systematic Names

  • 3,5-Dimethoxyphenol
  • Phenol, 3,5-dimethoxy-
  • Phenol, 3,5-dimethoxy- (8CI)(9CI)

Registry Numbers

CAS Registry Number

  • 500-99-2

FDA UNII

  • 23UXW8136A

System Generated Number

  • 0000500992

Structure Descriptors

InChI

1S/C8H10O3/c1-10-7-3-6(9)4-8(5-7)11-2/h3-5,9H,1-2H3

InChIKey

XQDNFAMOIPNVES-UHFFFAOYSA-N

Smiles

c1(cc(cc(c1)O)OC)OC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 37 deg C   EXP
pKa Dissociation Constant 9.34 (none) 25 EXP
log P (octanol-water) 1.64 (none)   EXP
Water Solubility 1.10E+04 mg/L 25 EST
Vapor Pressure 6.17E-03 mm Hg 25 EST
Henry's Law Constant 1.96E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.02E-10 cm3/molecule-sec 25 EST

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