Benzoic acid, 4,5-dihydroxy-2-nitro-, methyl ester (9CI)
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Benzoic acid, 4,5-dihydroxy-2-nitro-, methyl ester (9CI)
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CAS No:
773874-74-1
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Formula:
C8H7NO6
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Chemical Name:
Benzoic acid, 4,5-dihydroxy-2-nitro-, methyl ester (9CI)
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Synonyms:
methyl 4,5-dihydroxy-2-nitrobenzoate;ZINC39097366
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CAS No:
Computed Properties
Molecular Weight:213.14
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:213.02733694
Monoisotopic Mass:213.02733694
Topological Polar Surface Area:113
Heavy Atom Count:15
Complexity:262
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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