Methyl 3-iodo-4-(1-pyrrolidinyl)benzoate

CAS Registry Number®

1131614-28-2
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CAS Name

Methyl 3-iodo-4-(1-pyrrolidinyl)benzoate

Molecular Formula

C12H14INO2

Molecular Mass

331.15

Cite this Page

Methyl 3-iodo-4-(1-pyrrolidinyl)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1131614-28-2 (retrieved 2024-09-19) (CAS RN: 1131614-28-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H14INO2/c1-16-12(15)9-4-5-11(10(13)8-9)14-6-2-3-7-14/h4-5,8H,2-3,6-7H2,1H3

InChIKey

InChIKey=VZYZSXPFBWRZEY-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3-iodo-4-(1-pyrrolidinyl)-, methyl ester
  • Methyl 3-iodo-4-(1-pyrrolidinyl)benzoate