2-(1-Benzyl-1H-pyrazol-4-yl)-isonicotinic acid
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2-(1-Benzyl-1H-pyrazol-4-yl)-isonicotinic acid
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CAS No:
893723-63-2
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Formula:
C16H13N3O2
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Chemical Name:
2-(1-Benzyl-1H-pyrazol-4-yl)-isonicotinic acid
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Synonyms:
5-(Furan-2-yl)-nicotinic acid;5-(Furan-3-yl)-nicotinic acid;5-(Thiophen-3-yl)-nicotinic acid;2-(1-Benzyl-1H-pyrazol-4-yl)-isonicotinic acid;2-(1H-Pyrazol-4-yl)-isonicotinic acid;2-(1-Methyl-1H-pyrazol-4-yl)-isonicotinic acid;2-(5-Formylfuran-2-yl)-isonicotinic acid;2-(5-Methylfuran-2-yl)-isonicotinic acid
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CAS No:
Computed Properties
Molecular Weight:205.23
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:205.01974964
Monoisotopic Mass:205.01974964
Topological Polar Surface Area:78.4
Heavy Atom Count:14
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-(1-Benzyl-1H-pyrazol-4-yl)-isonicotinic acid
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