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Home > Aldehydes > 104129-40-0
104129-40-0 | Benzaldehyde, 2,5-dimethoxy-3,6-dimethyl-
CAS No: 104129-40-0 Catalog No: AG007WIZ MDL No:
Product Description
Catalog Number:
AG007WIZ
Chemical Name:
Benzaldehyde, 2,5-dimethoxy-3,6-dimethyl-
CAS Number:
104129-40-0
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
IUPAC Name:
2,5-dimethoxy-3,6-dimethylbenzaldehyde
InChI:
InChI=1S/C11H14O3/c1-7-5-10(13-3)8(2)9(6-12)11(7)14-4/h5-6H,1-4H3
InChI Key:
MAHSGSRMRDCYSY-UHFFFAOYSA-N
SMILES:
COc1cc(C)c(c(c1C)C=O)OC
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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