3-Iodo-2,6-dimethylbenzoic acid

CAS Registry Number®

123278-08-0

CAS Name

3-Iodo-2,6-dimethylbenzoic acid

Molecular Formula

C9H9IO2

Molecular Mass

276.07

Cite this Page

3-Iodo-2,6-dimethylbenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=123278-08-0 (retrieved 2024-11-24) (CAS RN: 123278-08-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    115-117 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H9IO2/c1-5-3-4-7(10)6(2)8(5)9(11)12/h3-4H,1-2H3,(H,11,12)

InChIKey

InChIKey=IISIKUKOZQFKSW-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(C)C(I)=CC=C1C

Canonical SMILES

O=C(O)C=1C(=CC=C(I)C1C)C

Other Names for this Substance

  • Benzoic acid, 3-iodo-2,6-dimethyl-
  • 3-Iodo-2,6-dimethylbenzoic acid
  • 2,6-Dimethyl-3-iodobenzoic acid

CAS INSIGHTSTM
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