CAS
120254-80-0 Purity
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120254-80-0 Purity
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Specification
The molecular formula is C11H16O2.
The molecular weight is 180.24 g/mol.
The IUPAC name is 1-(2,2-dimethoxyethyl)-3-methylbenzene.
The InChI is InChI=1S/C11H16O2/c1-9-5-4-6-10(7-9)8-11(12-2)13-3/h4-7,11H,8H2,1-3H3.
The InChIKey is YUQCSJRITDBZLT-UHFFFAOYSA-N.
The canonical SMILES is CC1=CC(=CC=C1)CC(OC)OC.
The CAS number is 134769-80-5.
The EC number is 693-805-7.
The hydrogen bond donor count is 0.
Yes, it is a canonicalized compound.