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Home > Aldehydes > 820237-56-7
820237-56-7 | Benzaldehyde,2-methoxy-3-methyl-4-propoxy-
CAS No: 820237-56-7 Catalog No: AG0053C8 MDL No:
Product Description
Catalog Number:
AG0053C8
Chemical Name:
Benzaldehyde,2-methoxy-3-methyl-4-propoxy-
CAS Number:
820237-56-7
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
IUPAC Name:
2-methoxy-3-methyl-4-propoxybenzaldehyde
InChI:
InChI=1S/C12H16O3/c1-4-7-15-11-6-5-10(8-13)12(14-3)9(11)2/h5-6,8H,4,7H2,1-3H3
InChI Key:
IBLSRZXDJNZBQC-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(c(c1C)OC)C=O
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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