4-(benzenesulfinylmethyl)-3-nitrobenzoic acid
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4-(benzenesulfinylmethyl)-3-nitrobenzoic acid
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CAS No:
110046-43-0
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Formula:
C14H11NO5S
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Chemical Name:
4-(benzenesulfinylmethyl)-3-nitrobenzoic acid
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Synonyms:
NSC635219;DTXSID40911469;NSC-635219;110046-43-0;4-(benzenesulfinylmethyl)-3-nitro-benzoic acid;4-[(Benzenesulfinyl)methyl]-3-nitrobenzoic acid;3-(Hydroxy(oxido)amino)-4-((phenylsulfinyl)methyl)benzoic acid
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CAS No:
4-(benzenesulfinylmethyl)-3-nitrobenzoic acid Basic Attributes
305.31 g/mol
305.03579362 g/mol
635219
Computed Properties
Molecular Weight:305.31
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:305.03579362
Monoisotopic Mass:305.03579362
Topological Polar Surface Area:119
Heavy Atom Count:21
Complexity:416
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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