Ethanone, 1-(3-methyl-4-isoxazolyl)- (9CI)
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Ethanone, 1-(3-methyl-4-isoxazolyl)- (9CI)
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CAS No:
58752-01-5
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Formula:
C6H7NO2
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Chemical Name:
Ethanone, 1-(3-methyl-4-isoxazolyl)- (9CI)
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Synonyms:
1-(3-methylisoxazol-4-yl)ethanone;1-(3-methyl-1,2-oxazol-4-yl)ethanone;Ethanone, 1-(3-methyl-4-isoxazolyl)- (9CI);1-(3-methyl-1,2-oxazol-4-yl)ethan-1-one;3-methyl-4-acetylisoxazole;SCHEMBL10085693;CTK8J4775;1-(3-methyl-4-isoxazolyl)ethanone;ZINC38582198;1-(3-methyl-isoxazol-4-yl)-ethanone
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CAS No:
Computed Properties
Molecular Weight:125.13
XLogP3:0.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:125.047678466
Monoisotopic Mass:125.047678466
Topological Polar Surface Area:43.1
Heavy Atom Count:9
Complexity:124
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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