2-[(3,4-dihydroxy-5-methoxyphenyl)methylidene]propanedinitrile
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![2-[(3,4-dihydroxy-5-methoxyphenyl)methylidene]propanedinitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8fc9eda6d2c649f391c24c5ed603956c.png "2-[(3,4-dihydroxy-5-methoxyphenyl)methylidene]propanedinitrile")
2-[(3,4-dihydroxy-5-methoxyphenyl)methylidene]propanedinitrile
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CAS No:
118409-54-4
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Formula:
C11H8N2O3
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Chemical Name:
2-[(3,4-dihydroxy-5-methoxyphenyl)methylidene]propanedinitrile
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Synonyms:
3-methoxyl-5-(2-,2-dicyanoethenyl)catechol;AG 34;AG-34;Tyrphostin AG 34;2-[(3,4-dihydroxy-5-methoxyphenyl)methylidene]propanedinitrile;2-[(3,4-dihydroxy-5-methoxyphenyl)methylene]malononitrile;2-(3,4-Dihydroxy-5-methoxybenzylidene)malononitrile;AG-34;Tyrphostin A24;Lopac-T-6318;Lopac0_001169;Oprea1_550548;CHEMBL80155;BDBM4340;SCHEMBL3459584;ZINC15332;MCK103237;MFCD00814022;AKOS024319659;CCG-205243;MCULE-6367545167;NCGC00016036-01;NCGC00016036-02;NCGC00016036-03;NCGC00094427-01;NCGC00094427-02;benzylidenemalononitrile (BMN) deriv. 24;EU-0101169;T 6318;(3,4-Dihydroxy-5-methoxybenzylidene)malononitrile;SR-01000076166;SR-01000076166-1;118409-54-4
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CAS No:
2-[(3,4-dihydroxy-5-methoxyphenyl)methylidene]propanedinitrile Basic Attributes
216.19 g/mol
216.05349212 g/mol
Computed Properties
Molecular Weight:216.19
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:216.05349212
Monoisotopic Mass:216.05349212
Topological Polar Surface Area:97.3
Heavy Atom Count:16
Complexity:355
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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