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Home > Aldehydes > 106662-32-2
106662-32-2 | Benzaldehyde, 3-(acetyloxy)-4-methoxy-2-(2-propenyl)-
CAS No: 106662-32-2 Catalog No: AG007C92 MDL No:
Product Description
Catalog Number:
AG007C92
Chemical Name:
Benzaldehyde, 3-(acetyloxy)-4-methoxy-2-(2-propenyl)-
CAS Number:
106662-32-2
Molecular Formula:
C13H14O4
Molecular Weight:
234.2479
IUPAC Name:
(3-formyl-6-methoxy-2-prop-2-enylphenyl) acetate
InChI:
InChI=1S/C13H14O4/c1-4-5-11-10(8-14)6-7-12(16-3)13(11)17-9(2)15/h4,6-8H,1,5H2,2-3H3
InChI Key:
HHEDSDDSNWCDES-UHFFFAOYSA-N
SMILES:
C=CCc1c(C=O)ccc(c1OC(=O)C)OC
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.089g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.251g/mol
Monoisotopic Mass:
234.089g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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