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Substance Name: 4-Nonylphenol
RN: 104-40-5
UNII: I03GBV4WEL
InChIKey: IGFHQQFPSIBGKE-UHFFFAOYSA-N

Classification Code

  • TSCA Flag S (Substance is Identified in a Proposed or Final SNUR (Significant New Use Rule) under TSCA)

Molecular Formula

  • C15-H24-O

Molecular Weight

  • 220.354
 
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Names and Synonyms

Name of Substance

  • 4-Nonylphenol

Synonyms

  • 3-06-00-02067 (Beilstein Handbook Reference)
  • 4-Nonylphenol
  • BRN 2047450
  • CCRIS 1251
  • EINECS 203-199-4
  • HSDB 5359
  • p-n-Nonylphenol
  • p-Nonylphenol
  • para-Nonylphenol
  • Phenol, 4-nonyl-
  • Phenol, p-nonyl-
  • UNII-I03GBV4WEL

Systematic Names

  • 4-Nonylphenol
  • p-Nonylphenol
  • Phenol, 4-nonyl-
  • Phenol, p-nonyl-

Registry Numbers

CAS Registry Number

  • 104-40-5

FDA UNII

  • I03GBV4WEL

Other Registry Number

  • 29832-11-9

System Generated Number

  • 0000104405

Structure Descriptors

InChI

1S/C15H24O/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h10-13,16H,2-9H2,1H3

InChIKey

IGFHQQFPSIBGKE-UHFFFAOYSA-N

Smiles

c1(ccc(O)cc1)CCCCCCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 1620mg/kg (1620mg/kg)   National Technical Information Service. Vol. PB85-143766,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 42 deg C   EXP
log P (octanol-water) 5.76 (none)   EXP
Water Solubility 7 mg/L 25 EXP
Vapor Pressure 8.18E-04 mm Hg 25 EXP
Henry's Law Constant 3.40E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.17E-11 cm3/molecule-sec 25 EST

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