CAS
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Specification
The molecular formula is C9H10O3.
The molecular weight is 166.17 g/mol.
The IUPAC name is (2R)-2-phenoxypropanoic acid.
The InChI is InChI=1S/C9H10O3/c1-7(9(10)11)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)/t7-/m1/s1.
The InChIKey is SXERGJJQSKIUIC-SSDOTTSWSA-N.
The canonical SMILES is CC(C(=O)O)OC1=CC=CC=C1.
It has 1 hydrogen bond donor count.
It has 3 hydrogen bond acceptor counts.
The topological polar surface area is 46.5Ų.
Yes, it is a canonicalized compound.