2-[(propan-2-ylcarbamothioylhydrazinylidene)methyl]benzoic acid
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![2-[(propan-2-ylcarbamothioylhydrazinylidene)methyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220805/87db6840d1af412498320ef7932fe038.png "2-[(propan-2-ylcarbamothioylhydrazinylidene)methyl]benzoic acid")
2-[(propan-2-ylcarbamothioylhydrazinylidene)methyl]benzoic acid
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CAS No:
80190-22-3
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Formula:
C12H15N3O2S
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Chemical Name:
2-[(propan-2-ylcarbamothioylhydrazinylidene)methyl]benzoic acid
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Synonyms:
AKOS034361033;MCULE-5992694579;Z44911615;2-[({[(propan-2-yl)carbamothioyl]amino}imino)methyl]benzoic acid;80190-22-3
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CAS No:
2-[(propan-2-ylcarbamothioylhydrazinylidene)methyl]benzoic acid Basic Attributes
265.33 g/mol
265.08849790 g/mol
Computed Properties
Molecular Weight:265.33
XLogP3:1.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:265.08849790
Monoisotopic Mass:265.08849790
Topological Polar Surface Area:106
Heavy Atom Count:18
Complexity:331
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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