S-(4-methoxyphenyl) 4-nitrobenzenecarbothioate
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S-(4-methoxyphenyl) 4-nitrobenzenecarbothioate
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CAS No:
6631-97-6
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Formula:
C14H11NO4S
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Chemical Name:
S-(4-methoxyphenyl) 4-nitrobenzenecarbothioate
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Synonyms:
6631-97-6;NSC57954;NCIOpen2_002292;DTXSID00984891;ZINC1688792;NSC-57954;S-(4-methoxyphenyl) 4-nitrobenzothioate;S-(4-Methoxyphenyl) 4-nitrobenzene-1-carbothioate;4-Nitro-thiobenzoic acid S-(4-methoxy-phenyl) ester
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CAS No:
S-(4-methoxyphenyl) 4-nitrobenzenecarbothioate Basic Attributes
289.31 g/mol
289.04087901 g/mol
57954
Computed Properties
Molecular Weight:289.31
XLogP3:3.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:289.04087901
Monoisotopic Mass:289.04087901
Topological Polar Surface Area:97.4
Heavy Atom Count:20
Complexity:342
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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