1-adamantylmethyl 1-oxidopyridin-1-ium-3-carboxylate
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1-adamantylmethyl 1-oxidopyridin-1-ium-3-carboxylate
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CAS No:
64140-44-9
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Formula:
C17H21NO3
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Chemical Name:
1-adamantylmethyl 1-oxidopyridin-1-ium-3-carboxylate
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Synonyms:
Nicotinic acid,1-adamantylmethyl ester,N-oxide; 1-oxy-nicotinic acid adamantan-1-ylmethyl ester; 1-Adamantylmethyl nicotinate N-oxide;
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CAS No:
1-adamantylmethyl 1-oxidopyridin-1-ium-3-carboxylate Basic Attributes
287.35400
287.15214353 g/mol
DTXSID60214348
Computed Properties
Molecular Weight:287.35
XLogP3:2.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:287.15214353
Monoisotopic Mass:287.15214353
Topological Polar Surface Area:51.8
Heavy Atom Count:21
Complexity:381
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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