[2-(3-iodoanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate
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[2-(3-iodoanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate
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CAS No:
735335-77-0
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Formula:
C14H11IN2O4
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Chemical Name:
[2-(3-iodoanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate
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Synonyms:
ZINC3319846;AKOS033631203;SR-01000044119;SR-01000044119-1;Z18553623;3-({[(3-iodophenyl)carbamoyl]methoxy}carbonyl)pyridin-1-ium-1-olate;735335-77-0
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CAS No:
[2-(3-iodoanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate Basic Attributes
398.15 g/mol
397.97635 g/mol
Computed Properties
Molecular Weight:398.15
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:397.97635
Monoisotopic Mass:397.97635
Topological Polar Surface Area:80.9
Heavy Atom Count:21
Complexity:380
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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