(3,4,5-trihydroxyoxan-2-yl)methyl 4-methylbenzenesulfonate
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(3,4,5-trihydroxyoxan-2-yl)methyl 4-methylbenzenesulfonate
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CAS No:
85906-16-7
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Formula:
C13H18O7S
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Chemical Name:
(3,4,5-trihydroxyoxan-2-yl)methyl 4-methylbenzenesulfonate
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Synonyms:
85906-16-7;NSC231894;DTXSID70310805;NSC-231894;2,6-Anhydro-1-O-(4-methylbenzene-1-sulfonyl)hexitol
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CAS No:
(3,4,5-trihydroxyoxan-2-yl)methyl 4-methylbenzenesulfonate Basic Attributes
318.34 g/mol
318.07732408 g/mol
231894
DTXSID70310805
Computed Properties
Molecular Weight:318.34
XLogP3:-0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:318.07732408
Monoisotopic Mass:318.07732408
Topological Polar Surface Area:122
Heavy Atom Count:21
Complexity:424
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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