2-[[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid
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![2-[[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b7ba7f572a954c83b1b23afb9d4b664a.png "2-[[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid")
2-[[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid
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CAS No:
122000-22-0
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Formula:
C17H17N3O2S
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Chemical Name:
2-[[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid
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Synonyms:
HMS2750M03;AKOS034359434;MCULE-4222921334;Z44862344;2-[({[(2,6-dimethylphenyl)carbamothioyl]amino}imino)methyl]benzoic acid;122000-22-0
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CAS No:
2-[[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid Basic Attributes
327.4 g/mol
327.10414797 g/mol
Computed Properties
Molecular Weight:327.4
XLogP3:3.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:327.10414797
Monoisotopic Mass:327.10414797
Topological Polar Surface Area:106
Heavy Atom Count:23
Complexity:445
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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