(2S)-2-amino-3-[2-[(2S)-2-amino-2-carboxyethyl]phenyl]propanoic acid
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![(2S)-2-amino-3-[2-[(2S)-2-amino-2-carboxyethyl]phenyl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/cf36946166d7438b9a9df5484945c50e.png "(2S)-2-amino-3-[2-[(2S)-2-amino-2-carboxyethyl]phenyl]propanoic acid")
(2S)-2-amino-3-[2-[(2S)-2-amino-2-carboxyethyl]phenyl]propanoic acid
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CAS No:
107476-00-6
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Formula:
C12H16N2O4
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Chemical Name:
(2S)-2-amino-3-[2-[(2S)-2-amino-2-carboxyethyl]phenyl]propanoic acid
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Synonyms:
SCHEMBL9164980;3,3'-o-Phenylenedi(L-alanine);ZINC2111574;1,2-Benzenedipropanoic acid,alpha,alpha'-diamino-,[S-(R*,R*)]- (9CI);107476-00-6
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CAS No:
(2S)-2-amino-3-[2-[(2S)-2-amino-2-carboxyethyl]phenyl]propanoic acid Basic Attributes
252.27 g/mol
252.11100700 g/mol
Computed Properties
Molecular Weight:252.27
XLogP3:-4.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:252.11100700
Monoisotopic Mass:252.11100700
Topological Polar Surface Area:127
Heavy Atom Count:18
Complexity:279
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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