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Specification
The molecular formula of 3-(Hexyloxy)benzaldehyde is C13H18O2.
The molecular weight of 3-(Hexyloxy)benzaldehyde is 206.28 g/mol.
The IUPAC name of 3-(Hexyloxy)benzaldehyde is 3-hexoxybenzaldehyde.
The InChI of 3-(Hexyloxy)benzaldehyde is InChI=1S/C13H18O2/c1-2-3-4-5-9-15-13-8-6-7-12(10-13)11-14/h6-8,10-11H,2-5,9H2,1H3.
The InChIKey of 3-(Hexyloxy)benzaldehyde is DUKQOJQWLCELHT-UHFFFAOYSA-N.
The canonical SMILES of 3-(Hexyloxy)benzaldehyde is CCCCCCOC1=CC=CC(=C1)C=O.
The XLogP3 value of 3-(Hexyloxy)benzaldehyde is 4.
3-(Hexyloxy)benzaldehyde has 0 hydrogen bond donor counts.
3-(Hexyloxy)benzaldehyde has 2 hydrogen bond acceptor counts.
3-(Hexyloxy)benzaldehyde has 7 rotatable bond counts.