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Specification
The molecular formula of 4-(2-phenylethoxy)benzaldehyde is C15H14O2.
The molecular weight of 4-(2-phenylethoxy)benzaldehyde is 226.27 g/mol.
The IUPAC name of 4-(2-phenylethoxy)benzaldehyde is 4-(2-phenylethoxy)benzaldehyde.
The InChI of 4-(2-phenylethoxy)benzaldehyde is InChI=1S/C15H14O2/c16-12-14-6-8-15(9-7-14)17-11-10-13-4-2-1-3-5-13/h1-9,12H,10-11H2.
The InChIKey of 4-(2-phenylethoxy)benzaldehyde is NWWORWIYBLAYJD-UHFFFAOYSA-N.
The canonical SMILES of 4-(2-phenylethoxy)benzaldehyde is C1=CC=C(C=C1)CCOC2=CC=C(C=C2)C=O.
The XLogP3-AA value of 4-(2-phenylethoxy)benzaldehyde is 3.3.
There are 0 hydrogen bond donor counts in 4-(2-phenylethoxy)benzaldehyde.
There are 2 hydrogen bond acceptor counts in 4-(2-phenylethoxy)benzaldehyde.
There are 5 rotatable bond counts in 4-(2-phenylethoxy)benzaldehyde.