S-(2-acetamidoethyl) benzenecarbothioate
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S-(2-acetamidoethyl) benzenecarbothioate
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CAS No:
91133-15-2
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Formula:
C11H13NO2S
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Chemical Name:
S-(2-acetamidoethyl) benzenecarbothioate
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Synonyms:
S-(2-acetamidoethyl) benzenecarbothioate;91133-15-2;NSC134459;S-benzoyl-N-acetyl-cysteamine;SCHEMBL9319940;CHEMBL1971917;DTXSID50300042;Acetamide, benzoate (6CI, 7CI);ZINC1721182;NSC-134459;FT-0726800;Thiobenzoic acid S-[2-(acetylamino)ethyl] ester;Benzenecarbothioic acid,S-[2-(acetylamino)ethyl] ester
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CAS No:
S-(2-acetamidoethyl) benzenecarbothioate Basic Attributes
223.29 g/mol
223.06669983 g/mol
134459
DTXSID50300042
Computed Properties
Molecular Weight:223.29
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:223.06669983
Monoisotopic Mass:223.06669983
Topological Polar Surface Area:71.5
Heavy Atom Count:15
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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