4-(2,5-dimethylphenyl)-2-methyl-4-oxobutanoic acid
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4-(2,5-dimethylphenyl)-2-methyl-4-oxobutanoic acid
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CAS No:
16206-40-9
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Formula:
C13H16O3
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Chemical Name:
4-(2,5-dimethylphenyl)-2-methyl-4-oxobutanoic acid
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Synonyms:
16206-40-9;2-Methyl-3-(2,5-dimethylbenzoyl)propanoic acid;4-(2,5-Dimethylphenyl)-2-methyl-4-oxobutanoic acid;NSC78726;Benzenebutanoic acid, a,2,5-trimethyl-g-oxo-;NCIOpen2_004177;Propionic acid, 3-(2,5-dimethylbenzoyl)-2-methyl-;DTXSID20291852;NSC-78726;AKOS010910186;DS-006842;Benzenebutanoic acid,a,2,5-trimethyl-g-oxo-;Propionic acid,5-dimethylbenzoyl)-2-methyl-;3-(2,5-Dimethylbenzoyl)-2-methylpropionic acid;4-(2,5-dimethyl-phenyl)-2-methyl-4-oxo-butyric acid;4-(2,5-Dimethylphenyl)-2-methyl-4-oxobutanoic acid #
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CAS No:
4-(2,5-dimethylphenyl)-2-methyl-4-oxobutanoic acid Basic Attributes
220.26 g/mol
220.109944368 g/mol
78726
DTXSID20291852
Computed Properties
Molecular Weight:220.26
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:220.109944368
Monoisotopic Mass:220.109944368
Topological Polar Surface Area:54.4
Heavy Atom Count:16
Complexity:272
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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