4-(Methylthio)phenylalanine

CAS Registry Number®

1991-88-4
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CAS Name

4-(Methylthio)phenylalanine

Molecular Formula

C10H13NO2S

Molecular Mass

211.28

Cite this Page

4-(Methylthio)phenylalanine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1991-88-4 (retrieved 2024-08-10) (CAS RN: 1991-88-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    245-247 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H13NO2S/c1-14-8-4-2-7(3-5-8)6-9(11)10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)

InChIKey

InChIKey=CYPJHFKIGWANKM-UHFFFAOYSA-N

SMILES

C(C(C(O)=O)N)C1=CC=C(SC)C=C1

Canonical SMILES

O=C(O)C(N)CC1=CC=C(SC)C=C1

Other Names for this Substance

  • Phenylalanine, 4-(methylthio)-
  • Alanine, 3-[p-(methylthio)phenyl]-
  • 4-(Methylthio)phenylalanine
  • 4-Methylthiophenylalanine
  • p-(Methylmercapto)-DL-phenylalanine

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Deleted or Replaced CAS Registry Numbers

54516-08-4