L-Alanine benzyl ester p-toluenesulfonate salt
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L-Alanine benzyl ester p-toluenesulfonate salt

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A benzoxazine derivatives as modulators of chemokine receptors for treatment of inflammatory and immunoregulatory diseases.

Category
L-Amino Acids
Catalog number
BAT-008034
CAS number
42854-62-6
Molecular Formula
C10H13NO2.C7H8O3S
Molecular Weight
351.41
L-Alanine benzyl ester p-toluenesulfonate salt
IUPAC Name
benzyl (2S)-2-aminopropanoate;4-methylbenzenesulfonic acid
Synonyms
beta-Alanine benzyl ester p-toluenesulfonate
Appearance
White crystal powder
Purity
≥ 99% (HPLC)
Melting Point
114-116 °C
Boiling Point
256.5ºC at 760mmHg
Storage
Store at 2-8 °C
Solubility
Soluble in DMSO, Methanol
InChI
InChI=1S/C10H13NO2.C7H8O3S/c1-8(11)10(12)13-7-9-5-3-2-4-6-9;1-6-2-4-7(5-3-6)11(8,9)10/h2-6,8H,7,11H2,1H3;2-5H,1H3,(H,8,9,10)/t8-;/m0./s1
InChI Key
NWOPHJSSBMABBD-QRPNPIFTSA-N
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)O.CC(C(=O)OCC1=CC=CC=C1)N
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