CAS
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Specification
The molecular formula is C11H14O3.
The molecular weight is 194.23 g/mol.
The IUPAC name is 4-methoxy-3-propoxybenzaldehyde.
The InChI is InChI=1S/C11H14O3/c1-3-6-14-11-7-9(8-12)4-5-10(11)13-2/h4-5,7-8H,3,6H2,1-2H3.
The InChIKey is OQGTYVGUCWWYNK-UHFFFAOYSA-N.
The canonical SMILES is CCCOC1=C(C=CC(=C1)C=O)OC.
The XLogP3 value is 2.2.
It has 0 hydrogen bond donor count.
It has 3 hydrogen bond acceptor counts.
It has 5 rotatable bond counts.