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Home > Aldehydes > 374073-50-4
374073-50-4 | Benzaldehyde, 3,4-dimethoxy-2-(1-methyl-2-propenyl)-
CAS No: 374073-50-4 Catalog No: AG0079VW MDL No:
Product Description
Catalog Number:
AG0079VW
Chemical Name:
Benzaldehyde, 3,4-dimethoxy-2-(1-methyl-2-propenyl)-
CAS Number:
374073-50-4
Molecular Formula:
C13H16O3
Molecular Weight:
220.2643
IUPAC Name:
2-but-3-en-2-yl-3,4-dimethoxybenzaldehyde
InChI:
InChI=1S/C13H16O3/c1-5-9(2)12-10(8-14)6-7-11(15-3)13(12)16-4/h5-9H,1H2,2-4H3
InChI Key:
ACGZBFOCMHBUTC-UHFFFAOYSA-N
SMILES:
C=CC(c1c(C=O)ccc(c1OC)OC)C
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.268g/mol
Monoisotopic Mass:
220.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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