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L-beta-Aspartyl-L-Phenylalanine
[CAS# 13433-10-8]

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Identification
Name L-beta-Aspartyl-L-Phenylalanine
Synonyms (3S)-3-Amino-4-[[(1S)-2-Hydroxy-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-4-Oxo-Butanoic Acid; (3S)-3-Amino-4-[[(1S)-2-Hydroxy-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-4-Oxobutanoic Acid; (3S)-3-Amino-4-[[(1S)-1-(Benzyl)-2-Hydroxy-2-Keto-Ethyl]Amino]-4-Keto-Butyric Acid
Molecular Structure CAS#: 13433-10-8, L-beta-Aspartyl-L-Phenylalanine
Molecular Formula C13H16N2O5
Molecular Weight 280.28
CAS Registry Number 13433-10-8
EINECS 236-558-9
SMILES [C@H](NC(=O)[C@@H](N)CC(=O)O)(CC1=CC=CC=C1)C(=O)O
InChI 1S/C13H16N2O5/c14-9(7-11(16)17)12(18)15-10(13(19)20)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7,14H2,(H,15,18)(H,16,17)(H,19,20)/t9-,10-/m0/s1
InChIKey YZQCXOFQZKCETR-UWVGGRQHSA-N
Properties
Density 1.371g/cm3 (Cal.)
Boiling point 601.677°C at 760 mmHg (Cal.)
Flash point 317.683°C (Cal.)
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