3-Iodo-4-(1-pyrrolidinyl)benzoic acid

CAS Registry Number®

1131588-16-3
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CAS Name

3-Iodo-4-(1-pyrrolidinyl)benzoic acid

Molecular Formula

C11H12INO2

Molecular Mass

317.12

Cite this Page

3-Iodo-4-(1-pyrrolidinyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1131588-16-3 (retrieved 2024-04-20) (CAS RN: 1131588-16-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H12INO2/c12-9-7-8(11(14)15)3-4-10(9)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2,(H,14,15)

InChIKey

InChIKey=HEJDNUMEEPEOLR-UHFFFAOYSA-N

SMILES

IC1=C(C=CC(C(O)=O)=C1)N2CCCC2

Canonical SMILES

O=C(O)C1=CC=C(C(I)=C1)N2CCCC2

Other Names for this Substance

  • Benzoic acid, 3-iodo-4-(1-pyrrolidinyl)-
  • 3-Iodo-4-(1-pyrrolidinyl)benzoic acid

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