CAS
94565-18-1 Purity
96%
94565-18-1 Purity
96%
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Specification
The molecular formula is C13H17BrO6.
It was created on 2017-09-15.
The IUPAC name is (2R,3R,4S,5S,6R)-2-[(4-bromophenyl)methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
The InChIKey is PTQSDKWCEKULBE-UJPOAAIJSA-N.
The molecular weight is 349.17 g/mol.
It has 4 hydrogen bond donor counts.
The XLogP3 value is 0.
It has 6 hydrogen bond acceptor counts.
The formal charge is 0.
Yes, it is a canonicalized compound.