Benzoic acid, 4-amino-2-mercapto-, ethyl ester (9CI)
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Benzoic acid, 4-amino-2-mercapto-, ethyl ester (9CI)
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CAS No:
345910-57-8
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Formula:
C9H11NO2S
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Chemical Name:
Benzoic acid, 4-amino-2-mercapto-, ethyl ester (9CI)
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Synonyms:
Ethyl 4-amino-2-sulfanylbenzoate;ZINC39084411
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CAS No:
Computed Properties
Molecular Weight:197.26
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:197.05104977
Monoisotopic Mass:197.05104977
Topological Polar Surface Area:53.3
Heavy Atom Count:13
Complexity:187
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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