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Home > Aldehydes > 805250-50-4
805250-50-4 | [1,1'-Biphenyl]-3-carboxaldehyde, 4'-(2-ethoxyethoxy)-2',6'-dimethyl-
CAS No: 805250-50-4 Catalog No: AG0059HJ MDL No:
Product Description
Catalog Number:
AG0059HJ
Chemical Name:
[1,1'-Biphenyl]-3-carboxaldehyde, 4'-(2-ethoxyethoxy)-2',6'-dimethyl-
CAS Number:
805250-50-4
Molecular Formula:
C19H22O3
Molecular Weight:
298.3762
IUPAC Name:
3-[4-(2-ethoxyethoxy)-2,6-dimethylphenyl]benzaldehyde
InChI:
InChI=1S/C19H22O3/c1-4-21-8-9-22-18-10-14(2)19(15(3)11-18)17-7-5-6-16(12-17)13-20/h5-7,10-13H,4,8-9H2,1-3H3
InChI Key:
CVMSOOLBCASESX-UHFFFAOYSA-N
SMILES:
CCOCCOc1cc(C)c(c(c1)C)c1cccc(c1)C=O
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.157g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.382g/mol
Monoisotopic Mass:
298.157g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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