4-methyl-2-(sulfanylmethyl)pentanoic acid
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4-methyl-2-(sulfanylmethyl)pentanoic acid
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CAS No:
127376-66-3
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Formula:
C7H14O2S
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Chemical Name:
4-methyl-2-(sulfanylmethyl)pentanoic acid
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Synonyms:
2-(mercaptomethyl)-4-methylpentanoic acid;H-psi-(SCH2)leucine;4-methyl-2-(sulfanylmethyl)pentanoic acid;CHEMBL354045;127376-66-3;Pentanoic acid, 2-(mercaptomethyl)-4-methyl-;168540-19-0;H-psi-(sch2)leucine;2-(Mercaptomethyl)-4-methylpentanoic acid;SCHEMBL841290;DTXSID50925875;BDBM50109591;2-(Mercaptomethyl)-4-methylvaleric acid;2-Mercaptomethyl-4-methyl-pentanoic acid;2-[(r,s)-mercaptomethyl]-4-methylpentanoic acid
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CAS No:
Computed Properties
Molecular Weight:162.25
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:162.07145086
Monoisotopic Mass:162.07145086
Topological Polar Surface Area:38.3
Heavy Atom Count:10
Complexity:112
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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