90906-75-5 Purity
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Specification
The molecular formula is C6H11ClO2.
The IUPAC name is 1-chloro-3-prop-2-enoxypropan-2-ol.
The molecular weight is 150.60 g/mol.
The InChI is InChI=1S/C6H11ClO2/c1-2-3-9-5-6(8)4-7/h2,6,8H,1,3-5H2.
The InChIKey is DLVRPVNJFWEIFV-UHFFFAOYSA-N.
The canonical SMILES is C=CCOCC(CCl)O.
The CAS number is 4638-03-3.
There is 1 hydrogen bond donor count.
There are 2 hydrogen bond acceptor counts.
Yes, 1-Allyloxy-3-chloro-2-propanol is a canonicalized compound.