4-Bromo-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile
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![4-Bromo-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1aad40779b934a7da29c7e3b211dba9a.png "4-Bromo-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile")
4-Bromo-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile
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CAS No:
52200-18-7
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Formula:
C12H11BrN2O
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Chemical Name:
4-Bromo-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile
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Synonyms:
Benzenepropanenitrile,4-bromo-α-[(dimethylamino)methylene]-β-oxo-;4-Bromo-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile;2-(4-Bromobenzoyl)-3-(dimethylamino)acrylonitrile;2-(4-Bromobenzoyl)-3-(dimethylamino)prop-2-enenitrile
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CAS No:
4-Bromo-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile Basic Attributes
279.13300
279.13
DTXSID80654085
2926909090
Computed Properties
Molecular Weight:279.13
XLogP3:2.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:278.00548
Monoisotopic Mass:278.00548
Topological Polar Surface Area:44.1
Heavy Atom Count:16
Complexity:332
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-Bromo-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile
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