3-Carboxy-1-methylpyridinium
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3-Carboxy-1-methylpyridinium
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CAS No:
7164-65-0
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Formula:
C7H8NO2
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Chemical Name:
3-Carboxy-1-methylpyridinium
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Synonyms:
Pyridinium,3-carboxy-1-methyl-;3-Carboxy-1-methylpyridinium;3-Carboxy-1-methylpyridinium ion;N-Methylnicotinic acid;1-N-Methylnicotinic acid;1-Methyl-3-carboxypyridinium;3-Carboxy-1-methylpyridin-1-ium
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CAS No:
Description
N-methylnicotinic acid is a pyridinium ion consisting of nicotinic acid having a methyl substituent on the pyridine nitrogen. It has a role as a plant metabolite. It derives from a nicotinic acid. It is a conjugate acid of a N-methylnicotinate.
Computed Properties
Molecular Weight:138.14
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:138.055503498
Monoisotopic Mass:138.055503498
Topological Polar Surface Area:41.2
Heavy Atom Count:10
Formal Charge:1
Complexity:136
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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