Butanethioic acid, 3-methyl-, S-2-pyridinyl ester (9CI)
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Butanethioic acid, 3-methyl-, S-2-pyridinyl ester (9CI)
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CAS No:
139007-44-6
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Formula:
C10H13NOS
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Chemical Name:
Butanethioic acid, 3-methyl-, S-2-pyridinyl ester (9CI)
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Synonyms:
S-2-Pyridinyl 3-methylbutanethioate;Butanethioic acid, 3-methyl-, S-2-pyridinyl ester (9CI);S-Pyridin-2-yl 3-methylbutanethioate;ACMC-20myee;CTK0G9823;DTXSID60452561;ZINC39116760;3-Methylbutanethioic acid S-(2-pyridyl) ester
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CAS No:
Butanethioic acid, 3-methyl-, S-2-pyridinyl ester (9CI) Basic Attributes
195.28132
195.072
DTXSID60452561
Computed Properties
Molecular Weight:195.28
XLogP3:2.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:195.07178521
Monoisotopic Mass:195.07178521
Topological Polar Surface Area:55.3
Heavy Atom Count:13
Complexity:170
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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