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Substance Name: 4-Heptyloxyphenol
RN: 13037-86-0
UNII: W9GSE02182
InChIKey: HZBABTUFXQLADL-UHFFFAOYSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C13-H20-O2

Molecular Weight

  • 208.299
 
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Names and Synonyms

Name of Substance

  • 4-Heptyloxyphenol

Synonyms

  • 3-06-00-04391 (Beilstein Handbook Reference)
  • BRN 1871129
  • p-(Heptyloxy)phenol
  • p-n-Heptyloxyphenol
  • UNII-W9GSE02182

Systematic Names

  • 4-(Heptyloxy)phenol (9CI)
  • Phenol, 4-(heptyloxy)-
  • Phenol, p-(heptyloxy)-

Registry Numbers

CAS Registry Number

  • 13037-86-0

FDA UNII

  • W9GSE02182

System Generated Number

  • 0013037860

Structure Descriptors

InChI

1S/C13H20O2/c1-2-3-4-5-6-11-15-13-9-7-12(14)8-10-13/h7-10,14H,2-6,11H2,1H3

InChIKey

HZBABTUFXQLADL-UHFFFAOYSA-N

Smiles

c1(ccc(O)cc1)OCCCCCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 60-63 deg C   EXP
log P (octanol-water) 4.540 (none)   EST
Water Solubility 20 mg/L 25 EST
Vapor Pressure 8.63E-05 mm Hg 25 EST
Henry's Law Constant 1.82E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.56E-11 cm3/molecule-sec 25 EST

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