CAS
96592-19-7 Purity
96%
96592-19-7 Purity
96%
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Specification
The molecular formula is C13H14O3.
The molecular weight is 218.25 g/mol.
The IUPAC name is 2,4-bis(prop-2-enoxy)benzaldehyde.
The InChI is InChI=1S/C13H14O3/c1-3-7-15-12-6-5-11(10-14)13(9-12)16-8-4-2/h3-6,9-10H,1-2,7-8H2.
The InChIKey is GACDJVALBBJGQY-UHFFFAOYSA-N.
The canonical SMILES is C=CCOC1=CC(=C(C=C1)C=O)OCC=C.
The CAS number is 96601-10-4.
The hydrogen bond donor count is 0.
The hydrogen bond acceptor count is 3.
Yes, Chembrdg-bb 4021965 is a canonicalized compound.