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Home > Aldehydes > 860748-43-2
860748-43-2 | 2,6-Dimethyl-4-ethoxybenzaldehyde
CAS No: 860748-43-2 Catalog No: AG01EXVD MDL No:
Product Description
Catalog Number:
AG01EXVD
Chemical Name:
2,6-Dimethyl-4-ethoxybenzaldehyde
CAS Number:
860748-43-2
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
IUPAC Name:
4-ethoxy-2,6-dimethylbenzaldehyde
InChI:
InChI=1S/C11H14O2/c1-4-13-10-5-8(2)11(7-12)9(3)6-10/h5-7H,4H2,1-3H3
InChI Key:
GHPBPWUWHKNBRQ-UHFFFAOYSA-N
SMILES:
CCOc1cc(C)c(c(c1)C)C=O
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.099g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.231g/mol
Monoisotopic Mass:
178.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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