p-Nitrophenyl sulfate
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p-Nitrophenyl sulfate
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CAS No:
1080-04-2
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Formula:
C6H5NO6S
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Chemical Name:
p-Nitrophenyl sulfate
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Synonyms:
Sulfuric acid,mono(4-nitrophenyl) ester;Sulfuric acid,mono(p-nitrophenyl) ester;Phenol,p-nitro-,hydrogen sulfate;4-Nitrophenyl sulfate;p-Nitrophenyl sulfate
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CAS No:
Description
Solid
Solid
4-nitrophenyl hydrogen sulfate is an aryl sulfate the mono 4-nitrophenyl ester of sulfuric acid. It has a role as a human metabolite. It is an aryl sulfate and a C-nitro compound. It derives from a 4-nitrophenol. It is a conjugate acid of a 4-nitrophenyl sulfate.
Computed Properties
Molecular Weight:219.17
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:218.98375805
Monoisotopic Mass:218.98375805
Topological Polar Surface Area:118
Heavy Atom Count:14
Complexity:293
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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