benzyl carbamimidothioate,3-methylbutanoic acid
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benzyl carbamimidothioate,3-methylbutanoic acid
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CAS No:
2412-36-4
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Formula:
C13H20N2O2S
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Chemical Name:
benzyl carbamimidothioate,3-methylbutanoic acid
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Synonyms:
S-Benzyl-isothioharnstoff,Isovalerat; S-benzyl-isothiourea,isovalerate;
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CAS No:
benzyl carbamimidothioate,3-methylbutanoic acid Basic Attributes
268.37500
268.12454906 g/mol
38890
DTXSID70284774
2930909090
Computed Properties
Molecular Weight:268.38
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:268.12454906
Monoisotopic Mass:268.12454906
Topological Polar Surface Area:113
Heavy Atom Count:18
Complexity:197
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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