CAS
96953-71-8 Purity
96%
96953-71-8 Purity
96%
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Specification
The molecular formula is C20H42O3.
The molecular weight is 330.5 g/mol.
The IUPAC name is (2S)-3-hexadecoxy-2-methoxypropan-1-ol.
The InChI is InChI=1S/C20H42O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-19-20(18-21)22-2/h20-21H,3-19H2,1-2H3/t20-/m0/s1.
There is 1 hydrogen bond donor count.
The XLogP3-AA value is 7.1.
There are 19 rotatable bond counts.
The topological polar surface area is 38.7 Ų.
There is 1 defined atom stereocenter count.
Yes, the compound is canonicalized.