2-phenylethanethioic S-acid
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2-phenylethanethioic S-acid
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CAS No:
62167-00-4
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Formula:
C8H8OS
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Chemical Name:
2-phenylethanethioic S-acid
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Synonyms:
PHENYLTHIOACETIC ACID;62167-00-4;benzeneethanethioic acid;DL-2-phenylthioacetic acid;2-phenylethanethioic S-acid;benzylthiocarboxylic acid;[O]C(=S)Cc1ccccc1;SCHEMBL698265;DTXSID60274487;ZINC2041149;AKOS006324069
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CAS No:
Computed Properties
Molecular Weight:152.22
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:152.02958605
Monoisotopic Mass:152.02958605
Topological Polar Surface Area:18.1
Heavy Atom Count:10
Complexity:116
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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