3-Bromo-5-butoxybenzoic acid

CAS Registry Number®

1228956-96-4
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CAS Name

3-Bromo-5-butoxybenzoic acid

Molecular Formula

C11H13BrO3

Molecular Mass

273.12

Cite this Page

3-Bromo-5-butoxybenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1228956-96-4 (retrieved 2024-06-26) (CAS RN: 1228956-96-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H13BrO3/c1-2-3-4-15-10-6-8(11(13)14)5-9(12)7-10/h5-7H,2-4H2,1H3,(H,13,14)

InChIKey

InChIKey=FSCCOARBZOWPJV-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CC(OCCCC)=CC(Br)=C1

Canonical SMILES

O=C(O)C=1C=C(Br)C=C(OCCCC)C1

Other Names for this Substance

  • Benzoic acid, 3-bromo-5-butoxy-
  • 3-Bromo-5-butoxybenzoic acid