(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 1-oxidopyridin-1-ium-3-carboxylate
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(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 1-oxidopyridin-1-ium-3-carboxylate
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CAS No:
571924-96-4
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Formula:
C15H12N2O7
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Chemical Name:
(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 1-oxidopyridin-1-ium-3-carboxylate
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Synonyms:
ZINC2661174;AKOS033631200;SR-01000054215;SR-01000054215-1;Z18553518;3-{[(6-nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methoxy]carbonyl}pyridin-1-ium-1-olate;571924-96-4
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CAS No:
(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 1-oxidopyridin-1-ium-3-carboxylate Basic Attributes
332.26 g/mol
332.06445073 g/mol
Computed Properties
Molecular Weight:332.26
XLogP3:0.5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:332.06445073
Monoisotopic Mass:332.06445073
Topological Polar Surface Area:116
Heavy Atom Count:24
Complexity:469
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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