4-(3,5-dimethylphenyl)-4-oxobutanoic acid
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4-(3,5-dimethylphenyl)-4-oxobutanoic acid
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CAS No:
36440-58-1
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Formula:
C12H14O3
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Chemical Name:
4-(3,5-dimethylphenyl)-4-oxobutanoic acid
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Synonyms:
4-(3,5-DIMETHYLPHENYL)-4-OXOBUTYRIC ACID; 3-(3,5-dimethylbenzoyl)propionic acid;
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CAS No:
4-(3,5-dimethylphenyl)-4-oxobutanoic acid Basic Attributes
206.23800
206.094294304 g/mol
DTXSID20342671
2918300090
Computed Properties
Molecular Weight:206.24
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:206.094294304
Monoisotopic Mass:206.094294304
Topological Polar Surface Area:54.4
Heavy Atom Count:15
Complexity:237
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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