3-Iodo-ζ-oxobenzeneheptanoic acid

CAS Registry Number®

898790-89-1

CAS Name

3-Iodo-ζ-oxobenzeneheptanoic acid

Molecular Formula

C13H15IO3

Molecular Mass

346.16

Cite this Page

3-Iodo-ζ-oxobenzeneheptanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898790-89-1 (retrieved 2024-12-21) (CAS RN: 898790-89-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H15IO3/c14-11-6-4-5-10(9-11)12(15)7-2-1-3-8-13(16)17/h4-6,9H,1-3,7-8H2,(H,16,17)

InChIKey

InChIKey=QNSRZYMQZSPGKJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CCCCCC(=O)C=1C=CC=C(I)C1

Other Names for this Substance

  • Benzeneheptanoic acid, 3-iodo-ζ-oxo-
  • 3-Iodo-ζ-oxobenzeneheptanoic acid

CAS INSIGHTSTM
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