3-nitro-4-pyridin-2-ylsulfanylbenzoic acid
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3-nitro-4-pyridin-2-ylsulfanylbenzoic acid
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CAS No:
219930-74-2
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Formula:
C12H8N2O4S
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Chemical Name:
3-nitro-4-pyridin-2-ylsulfanylbenzoic acid
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Synonyms:
HMS545F18; 3-nitro-4-(2-pyridylthio)benzoic acid;
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CAS No:
3-nitro-4-pyridin-2-ylsulfanylbenzoic acid Basic Attributes
276.26800
276.02047791 g/mol
DTXSID50351559
Computed Properties
Molecular Weight:276.27
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:276.02047791
Monoisotopic Mass:276.02047791
Topological Polar Surface Area:121
Heavy Atom Count:19
Complexity:347
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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