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Home > Aldehydes > 146119-99-5
146119-99-5 | Benzaldehyde, 4,4'-[1,8-octanediylbis(oxy)]bis[3,5-dimethoxy-
CAS No: 146119-99-5 Catalog No: AG001DP1 MDL No:
Product Description
Catalog Number:
AG001DP1
Chemical Name:
Benzaldehyde, 4,4'-[1,8-octanediylbis(oxy)]bis[3,5-dimethoxy-
CAS Number:
146119-99-5
Molecular Formula:
C26H34O8
Molecular Weight:
474.5434
IUPAC Name:
4-[8-(4-formyl-2,6-dimethoxyphenoxy)octoxy]-3,5-dimethoxybenzaldehyde
InChI:
InChI=1S/C26H34O8/c1-29-21-13-19(17-27)14-22(30-2)25(21)33-11-9-7-5-6-8-10-12-34-26-23(31-3)15-20(18-28)16-24(26)32-4/h13-18H,5-12H2,1-4H3
InChI Key:
UUCRXPSQDWVTKQ-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)cc(c1OCCCCCCCCOc1c(OC)cc(cc1OC)C=O)OC
Properties
Complexity:
483
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
474.225g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
474.55g/mol
Monoisotopic Mass:
474.225g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
89.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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