(3,3-dimethyl-2-oxobutyl) 4-cyanobenzoate
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(3,3-dimethyl-2-oxobutyl) 4-cyanobenzoate
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CAS No:
502866-74-2
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Formula:
C14H15NO3
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Chemical Name:
(3,3-dimethyl-2-oxobutyl) 4-cyanobenzoate
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Synonyms:
Oprea1_015923;HMS1766F19;ZINC3320176;AKOS033613439;MCULE-5853751351;3,3-dimethyl-2-oxobutyl 4-cyanobenzoate;SR-01000042591;SR-01000042591-1;Z18373002;502866-74-2
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CAS No:
Computed Properties
Molecular Weight:245.27
XLogP3:2.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:245.10519334
Monoisotopic Mass:245.10519334
Topological Polar Surface Area:67.2
Heavy Atom Count:18
Complexity:364
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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