S-Phenyl 2-butenethioate
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S-Phenyl 2-butenethioate
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CAS No:
25542-72-7
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Formula:
C10H10OS
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Chemical Name:
S-Phenyl 2-butenethioate
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Synonyms:
2-Butenethioic acid,S-phenyl ester;Crotonic acid,thio-,S-phenyl ester;S-Phenyl 2-butenethioate;Pennsalt TD 5063;S-Phenyl thiocrotonate;TD 5063;NSC 310531
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CAS No:
Computed Properties
Molecular Weight:178.25
XLogP3:3.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:178.04523611
Monoisotopic Mass:178.04523611
Topological Polar Surface Area:42.4
Heavy Atom Count:12
Complexity:169
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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