2-(1-amino-1-oxobutan-2-yl)sulfanyl-2-phenylacetic acid
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2-(1-amino-1-oxobutan-2-yl)sulfanyl-2-phenylacetic acid
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CAS No:
100391-23-9
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Formula:
C12H15NO3S
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Chemical Name:
2-(1-amino-1-oxobutan-2-yl)sulfanyl-2-phenylacetic acid
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Synonyms:
NSC84549;(1-carbamoyl-propylsulfanyl)-phenyl-acetic acid;NCIOpen2_005181;NSC-84549;100391-23-9
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CAS No:
2-(1-amino-1-oxobutan-2-yl)sulfanyl-2-phenylacetic acid Basic Attributes
253.32 g/mol
253.07726451 g/mol
84549
Computed Properties
Molecular Weight:253.32
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:253.07726451
Monoisotopic Mass:253.07726451
Topological Polar Surface Area:106
Heavy Atom Count:17
Complexity:277
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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