2-chloropentanethioic S-acid
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2-chloropentanethioic S-acid
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CAS No:
163401-68-1
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Formula:
C5H9ClOS
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Chemical Name:
2-chloropentanethioic S-acid
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Synonyms:
2-chloro-4-methylthiobutanoate;2-chloro-4-methylthiobutanoic acid;2-Cl-4-MTBA;2-Chloro-4-methylthiobutanoic acid;2-chloropentanethioic S-acid;163401-68-1;CCRIS 7292;SCHEMBL7824707;DTXSID50936825
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CAS No:
Computed Properties
Molecular Weight:152.64
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:152.0062638
Monoisotopic Mass:152.0062638
Topological Polar Surface Area:18.1
Heavy Atom Count:8
Complexity:84.5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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