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Substance Name: 4-Pentylphenol
RN: 14938-35-3
UNII: 40069Q368Q
InChIKey: ZNPSUQQXTRRSBM-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C11-H16-O

Molecular Weight

  • 164.246
 
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Names and Synonyms

Name of Substance

  • 4-Pentylphenol

Synonyms

  • 4-06-00-03370 (Beilstein Handbook Reference)
  • 4-Amylphenol
  • 4-n-Amylphenol
  • 4-n-Pentylphenol
  • 4-Pentylphenol
  • Amyl p-hydroxybenzene
  • BRN 1364424
  • EINECS 239-015-4
  • p-Amylphenol
  • p-Pentylphenol
  • UNII-40069Q368Q

Systematic Names

  • 4-Pentylphenol
  • Phenol, 4-pentyl-
  • Phenol, p-pentyl-

Registry Numbers

CAS Registry Number

  • 14938-35-3

FDA UNII

  • 40069Q368Q

Other Registry Number

  • 65916-15-6

System Generated Number

  • 0014938353

Structure Descriptors

InChI

1S/C11H16O/c1-2-3-4-5-10-6-8-11(12)9-7-10/h6-9,12H,2-5H2,1H3

InChIKey

ZNPSUQQXTRRSBM-UHFFFAOYSA-N

Smiles

c1(ccc(O)cc1)CCCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 23 deg C   EXP
Boiling Point 250.5 deg C   EXP
log P (octanol-water) 4.06 (none)   EXP
Water Solubility 84.8 mg/L 25 EST
Vapor Pressure 2.29E-03 mm Hg 25 EST
Henry's Law Constant 1.92E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.60E-11 cm3/molecule-sec 25 EST

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