CAS
933-00-6 Purity
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933-00-6 Purity
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Specification
The molecular formula is C7H13NO7.
It was created on February 8, 2007.
The molecular weight is 223.18 g/mol.
It is computed as 2-(hydroxymethyl)-6-(nitromethyl)oxane-3,4,5-triol.
The InChI is InChI=1S/C7H13NO7/c9-2-4-6(11)7(12)5(10)3(15-4)1-8(13)14/h3-7,9-12H,1-2H2.
It has 4 hydrogen bond donor counts.
The XLogP3-AA value is -2.2.
It has 7 hydrogen bond acceptor counts.
The exact mass is 223.06920175 g/mol.
Yes, the compound is canonicalized.