4-[4-Hydroxy-3-(1-methylethyl)phenoxy]-3,5-diiodobenzeneacetic acid

CAS Registry Number®

85828-81-5

CAS Name

4-[4-Hydroxy-3-(1-methylethyl)phenoxy]-3,5-diiodobenzeneacetic acid

Molecular Formula

C17H16I2O4

Molecular Mass

538.12

Cite this Page

4-[4-Hydroxy-3-(1-methylethyl)phenoxy]-3,5-diiodobenzeneacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=85828-81-5 (retrieved 2025-01-07) (CAS RN: 85828-81-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    162-164 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C17H16I2O4/c1-9(2)12-8-11(3-4-15(12)20)23-17-13(18)5-10(6-14(17)19)7-16(21)22/h3-6,8-9,20H,7H2,1-2H3,(H,21,22)

InChIKey

InChIKey=KSZBMSJSJFZGRF-UHFFFAOYSA-N

SMILES

O(C1=C(I)C=C(CC(O)=O)C=C1I)C2=CC(C(C)C)=C(O)C=C2

Canonical SMILES

O=C(O)CC1=CC(I)=C(OC2=CC=C(O)C(=C2)C(C)C)C(I)=C1

Other Names for this Substance

  • Benzeneacetic acid, 4-[4-hydroxy-3-(1-methylethyl)phenoxy]-3,5-diiodo-
  • Acetic acid, [4-[(4-hydroxy-m-cumenyl)oxy]-3,5-diiodophenyl]-
  • 4-[4-Hydroxy-3-(1-methylethyl)phenoxy]-3,5-diiodobenzeneacetic acid

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