L-Tyrosine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)

CAS Registry Number®

53587-11-4
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CAS Name

L-Tyrosine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)

Molecular Formula

C16H17NO3.C7H8O3S

Cite this Page

L-Tyrosine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=53587-11-4 (retrieved 2024-04-26) (CAS RN: 53587-11-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    179-180.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H17NO3.C7H8O3S/c17-15(10-12-6-8-14(18)9-7-12)16(19)20-11-13-4-2-1-3-5-13;1-6-2-4-7(5-3-6)11(8,9)10/h1-9,15,18H,10-11,17H2;2-5H,1H3,(H,8,9,10)/t15-;/m0./s1

InChIKey

InChIKey=PJGVHBLZZQDFFM-RSAXXLAASA-N

SMILES

C([C@@H](C(OCC1=CC=CC=C1)=O)N)C2=CC=C(O)C=C2.S(=O)(=O)(O)C1=CC=C(C)C=C1

Canonical SMILES

O=C(OCC=1C=CC=CC1)C(N)CC2=CC=C(O)C=C2.O=S(=O)(O)C1=CC=C(C=C1)C

Other Names for this Substance

  • L-Tyrosine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)
  • L-Tyrosine, phenylmethyl ester, 4-methylbenzenesulfonate (salt)
  • Tyrosine benzyl ester tosylate (salt)
  • Tyrosine benzyl ester tosylate
  • (S)-Tyrosine benzyl ester tosylate

Deleted or Replaced CAS Registry Numbers

139755-67-2

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