(2S)-2-acetamido-4-(2-chloroethylsulfanyl)butanoic acid
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(2S)-2-acetamido-4-(2-chloroethylsulfanyl)butanoic acid
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CAS No:
113793-52-5
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Formula:
C8H14ClNO3S
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Chemical Name:
(2S)-2-acetamido-4-(2-chloroethylsulfanyl)butanoic acid
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Synonyms:
113793-52-5;Homocysteine, N-acetyl-S-(2-chloroethyl)-;DTXSID10921196;S-(2-Chloroethyl)-N-(1-hydroxyethylidene)homocysteine
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CAS No:
(2S)-2-acetamido-4-(2-chloroethylsulfanyl)butanoic acid Basic Attributes
239.72 g/mol
239.0382922 g/mol
Computed Properties
Molecular Weight:239.72
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:239.0382922
Monoisotopic Mass:239.0382922
Topological Polar Surface Area:91.7
Heavy Atom Count:14
Complexity:201
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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