CAS
91748-18-4 Purity
96%
91748-18-4 Purity
96%
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Specification
The molecular formula is C11H15NO2.
The molecular weight is 193.24 g/mol.
The IUPAC name is 4-(oxan-4-yloxy)aniline.
The InChI is InChI=1S/C11H15NO2/c12-9-1-3-10(4-2-9)14-11-5-7-13-8-6-11/h1-4,11H,5-8,12H2.
The Canonical SMILES is C1COCCC1OC2=CC=C(C=C2)N.
The CAS number is 917483-71-7.
The XLogP3-AA value is 1.6.
There is 1 hydrogen bond donor count.
The topological polar surface area is 44.5 Å2.
Yes, it is a canonicalized compound.