4-(2,6-dimethylphenyl)sulfanylbutanoic acid
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4-(2,6-dimethylphenyl)sulfanylbutanoic acid
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CAS No:
72462-90-9
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Formula:
C12H16O2S
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Chemical Name:
4-(2,6-dimethylphenyl)sulfanylbutanoic acid
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Synonyms:
Butanoic acid, 4-((2,6-dimethylphenyl)thio)-;72462-90-9;DTXSID80222768;ZINC6071754
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CAS No:
4-(2,6-dimethylphenyl)sulfanylbutanoic acid Basic Attributes
224.32 g/mol
224.08710092 g/mol
DTXSID80222768
Computed Properties
Molecular Weight:224.32
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:224.08710092
Monoisotopic Mass:224.08710092
Topological Polar Surface Area:62.6
Heavy Atom Count:15
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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