Phenibut

CAS Registry Number®

1078-21-3
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CAS Name

Phenibut

Molecular Formula

C10H13NO2

Molecular Mass

179.22

Cite this Page

Phenibut.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1078-21-3 (retrieved 2024-04-24) (CAS RN: 1078-21-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    253 °C (decomp)

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C10H13NO2/c11-7-9(6-10(12)13)8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)

InChIKey

InChIKey=DAFOCGYVTAOKAJ-UHFFFAOYSA-N

SMILES

C(CC(O)=O)(CN)C1=CC=CC=C1

Canonical SMILES

O=C(O)CC(C=1C=CC=CC1)CN

Other Names for this Substance

  • Benzenepropanoic acid, β-(aminomethyl)-
  • Hydrocinnamic acid, β-(aminomethyl)-
  • β-(Aminomethyl)benzenepropanoic acid
  • Phenigam
  • Phenygam

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Deleted or Replaced CAS Registry Numbers

35568-37-7

CAS INSIGHTSTM
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