2-benzyl-3-sulfanylpropanoic acid
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2-benzyl-3-sulfanylpropanoic acid
structure -
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CAS No:
69734-01-6
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Formula:
C10H12O2S
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Chemical Name:
2-benzyl-3-sulfanylpropanoic acid
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Synonyms:
2-benzyl-3-mercaptopropanoic acid;SQ 14,603;SQ-14,603;SQ-14603;SQ14,603;2-benzyl-3-sulfanylpropanoic acid;SQ-14603;CHEMBL58957;69734-01-6;2-Benzyl-3-mercaptopropanoic acid;SQ14,603;SQ 14,603;Benzenepropanoic acid, alpha-(mercaptomethyl)-;SCHEMBL1559014;DTXSID80989900;2-Benzyl-3-mercapto-propionic acid;BDBM50109593;2-mercaptomethyl-3-phenylpropionic acid;2-Mercaptomethyl-3-phenyl-propionic acid;81110-55-6;3-Phenyl-2-(mercaptomethyl)propionic acid;SQ-14,603;Benzenepropanoic acid, alpha-(mercaptomethyl)-, (+-)-
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CAS No:
Computed Properties
Molecular Weight:196.27
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:196.05580079
Monoisotopic Mass:196.05580079
Topological Polar Surface Area:38.3
Heavy Atom Count:13
Complexity:164
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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