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4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]benzonitrile

4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]benzonitrile structure

CAS No:
53942-70-4
Formula:
C14H11NO4
Chemical Name:
4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]benzonitrile
Synonyms:
NSC636635;53942-70-4;4-[(2,2-Dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]benzonitrile;4-((2,2-Dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl)benzonitrile;SCHEMBL5201761;DTXSID30327176;HMS1662I21;ZINC140773;NSC379549;Benzonitrile, 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]-;MCULE-4966177033;NSC-379549;NSC-636635;2,2-Dimethyl-5-(4-cyanobenzylidene)-1,3-dioxane-4,6-dione;4-[(2,2-Dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]benzonitrile #

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4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]benzonitrile Basic Attributes

Molecular Weight：

257.24 g/mol

Exact Mass：

257.06880783 g/mol

NSC Number：

379549|636635

DSSTox ID：

DTXSID30327176

Characteristics

PSA：

76.4 Å²

Computed Properties

Molecular Weight:257.24
XLogP3:2.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:257.06880783
Monoisotopic Mass:257.06880783
Topological Polar Surface Area:76.4
Heavy Atom Count:19
Complexity:453
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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