Sodium phenylbutyrate

CAS Registry Number®

1716-12-7
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CAS Name

Sodium phenylbutyrate

Molecular Formula

C10H12O2.Na

Cite this Page

Sodium phenylbutyrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1716-12-7 (retrieved 2022-05-18) (CAS RN: 1716-12-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H12O2.Na/c11-10(12)8-4-7-9-5-2-1-3-6-9;/h1-3,5-6H,4,7-8H2,(H,11,12);

InChIKey

InChIKey=SMWRDNDNSFPORN-UHFFFAOYSA-N

SMILES

C(CCC(O)=O)C1=CC=CC=C1.[Na]

Canonical SMILES

[Na].O=C(O)CCCC=1C=CC=CC1

Other Names for this Substance

  • Benzenebutanoic acid, sodium salt (1:1)
  • Butyric acid, 4-phenyl-, sodium salt
  • Benzenebutanoic acid, sodium salt
  • Sodium phenylbutyrate
  • Sodium 4-phenylbutyrate