Benzoic acid, 2-[[(cyanoamino)methylene]amino]-, methyl ester (9CI)
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![Benzoic acid, 2-[[(cyanoamino)methylene]amino]-, methyl ester (9CI) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f0a1dc8189074d369dd7e2505ceb04d7.png "Benzoic acid, 2-[[(cyanoamino)methylene]amino]-, methyl ester (9CI)")
Benzoic acid, 2-[[(cyanoamino)methylene]amino]-, methyl ester (9CI)
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CAS No:
77021-79-5
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Formula:
C10H9N3O2
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Chemical Name:
Benzoic acid, 2-[[(cyanoamino)methylene]amino]-, methyl ester (9CI)
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Synonyms:
Methyl 2-{(Z)-[(cyanoamino)methylene]amino}benzoate;ZINC39085298
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CAS No:
Benzoic acid, 2-[[(cyanoamino)methylene]amino]-, methyl ester (9CI) Basic Attributes
203.19736
203.069
Computed Properties
Molecular Weight:203.20
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:203.069476538
Monoisotopic Mass:203.069476538
Topological Polar Surface Area:74.5
Heavy Atom Count:15
Complexity:292
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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