CAS
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Specification
The molecular formula is C16H16O3.
The molecular weight is 256.30 g/mol.
The IUPAC name is 3-methoxy-4-(2-phenylethoxy)benzaldehyde.
The InChI is InChI=1S/C16H16O3/c1-18-16-11-14(12-17)7-8-15(16)19-10-9-13-5-3-2-4-6-13/h2-8,11-12H,9-10H2,1H3.
The InChIKey is LMQXMNKNBDWQMB-UHFFFAOYSA-N.
The canonical SMILES is COC1=C(C=CC(=C1)C=O)OCCC2=CC=CC=C2.
The CAS number is 149428-74-0.
The XLogP3-AA value is 3.3.
It has 0 hydrogen bond donor counts.
It has 3 hydrogen bond acceptor counts.