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Specification
The molecular formula of 3-Ethoxy-4-isobutoxy-benzaldehyde is C13H18O3.
The molecular weight of 3-Ethoxy-4-isobutoxy-benzaldehyde is 222.28 g/mol.
The IUPAC name of 3-Ethoxy-4-isobutoxy-benzaldehyde is 3-ethoxy-4-(2-methylpropoxy)benzaldehyde.
The InChI of 3-Ethoxy-4-isobutoxy-benzaldehyde is InChI=1S/C13H18O3/c1-4-15-13-7-11(8-14)5-6-12(13)16-9-10(2)3/h5-8,10H,4,9H2,1-3H3.
The InChIKey of 3-Ethoxy-4-isobutoxy-benzaldehyde is BVHHJYYHHQIPCB-UHFFFAOYSA-N.
The canonical SMILES of 3-Ethoxy-4-isobutoxy-benzaldehyde is CCOC1=C(C=CC(=C1)C=O)OCC(C)C.
The CAS number of 3-Ethoxy-4-isobutoxy-benzaldehyde is 93567-91-0.
The molecular weight of 3-Ethoxy-4-isobutoxy-benzaldehyde according to PubChem 2.1 is 222.28 g/mol.
The XLogP3 value of 3-Ethoxy-4-isobutoxy-benzaldehyde is 3.3.
3-Ethoxy-4-isobutoxy-benzaldehyde has 3 hydrogen bond acceptor counts.