2-nitrobutyl 4-methylbenzenesulfonate
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2-nitrobutyl 4-methylbenzenesulfonate
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CAS No:
23531-32-0
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Formula:
C11H15NO5S
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Chemical Name:
2-nitrobutyl 4-methylbenzenesulfonate
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Synonyms:
2-Nitro-1-butyl-p-toluolsulfonat;
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CAS No:
2-nitrobutyl 4-methylbenzenesulfonate Basic Attributes
273.30600
273.06709375 g/mol
221159
DTXSID30310003
Computed Properties
Molecular Weight:273.31
XLogP3:2.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:273.06709375
Monoisotopic Mass:273.06709375
Topological Polar Surface Area:97.6
Heavy Atom Count:18
Complexity:362
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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