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L-Phenylalanine allyl ester 4-toluenesulfonate salt
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L-Phenylalanine allyl ester 4-toluenesulfonate salt

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Category
L-Amino Acids
Catalog number
BAT-004016
CAS number
88224-00-4
Molecular Formula
C12H15NO2·C7H8O3S
Molecular Weight
377.50
L-Phenylalanine allyl ester 4-toluenesulfonate salt
IUPAC Name
4-methylbenzenesulfonic acid;prop-2-enyl (2S)-2-amino-3-phenylpropanoate
Synonyms
L-Phe-OAll TosOH; (S)-Allyl 2-amino-3-phenylpropanoate 4-methylbenzenesulfonate; 4-methylbenzenesulfonic acid, prop-2-enyl(2S)-2-amino-3-phenylpropanoate
Appearance
White to off-white powder
Purity
≥ 98% (HPLC)
Melting Point
155-160 °C
Boiling Point
308.8 °C at 760 mmHg
Storage
Store at 2-8 °C
InChI
InChI=1S/C12H15NO2.C7H8O3S/c1-2-8-15-12(14)11(13)9-10-6-4-3-5-7-10;1-6-2-4-7(5-3-6)11(8,9)10/h2-7,11H,1,8-9,13H2;2-5H,1H3,(H,8,9,10)/t11-;/m0./s1
InChI Key
PKXPRZFLCJFMHN-MERQFXBCSA-N
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)O.C=CCOC(=O)C(CC1=CC=CC=C1)N
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