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Substance Name: (p-Iodophenoxy)acetic acid
RN: 1878-94-0
InChIKey: RKORKXFKXYYHAQ-UHFFFAOYSA-N

Molecular Formula

  • C8-H7-I-O3

Molecular Weight

  • 278.04
 
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Names and Synonyms

Synonym

  • EINECS 217-531-0

Systematic Name

  • (p-Iodophenoxy)acetic acid

Registry Numbers

CAS Registry Number

  • 1878-94-0

System Generated Number

  • 0001878940

Structure Descriptors

InChI

1S/C8H7IO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)

InChIKey

RKORKXFKXYYHAQ-UHFFFAOYSA-N

Smiles

OC(=O)COc1ccc(I)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
pKa Dissociation Constant 3.16 (none) 25 EXP
log P (octanol-water) 2.69 (none)   EXP
Water Solubility 206 mg/L 25 EST
Vapor Pressure 3.01E-05 mm Hg 25 EST
Henry's Law Constant 3.89E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.19E-11 cm3/molecule-sec 25 EST

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