4-nitro-3-(4-nitro-3-phenylmethoxyphenyl)sulfanylbenzoic acid
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4-nitro-3-(4-nitro-3-phenylmethoxyphenyl)sulfanylbenzoic acid
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CAS No:
313498-79-2
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Formula:
C20H14N2O7S
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Chemical Name:
4-nitro-3-(4-nitro-3-phenylmethoxyphenyl)sulfanylbenzoic acid
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Synonyms:
C20H14N2O7S;ZINC2025167;STL335434;AKOS022142035;MCULE-8446738802;ST50994938;3-{[3-(benzyloxy)-4-nitrophenyl]sulfanyl}-4-nitrobenzoic acid;4-nitro-3-[4-nitro-3-(phenylmethoxy)phenylthio]benzoic acid;313498-79-2
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CAS No:
4-nitro-3-(4-nitro-3-phenylmethoxyphenyl)sulfanylbenzoic acid Basic Attributes
426.4 g/mol
426.05217196 g/mol
Computed Properties
Molecular Weight:426.4
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:426.05217196
Monoisotopic Mass:426.05217196
Topological Polar Surface Area:164
Heavy Atom Count:30
Complexity:617
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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