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Home > Aldehydes > 877174-38-4
877174-38-4 | Benzaldehyde, 4-[[6-(3-formyl-5-methoxyphenoxy)hexyl]oxy]-3-methoxy-
CAS No: 877174-38-4 Catalog No: AG008DO4 MDL No:
Product Description
Catalog Number:
AG008DO4
Chemical Name:
Benzaldehyde, 4-[[6-(3-formyl-5-methoxyphenoxy)hexyl]oxy]-3-methoxy-
CAS Number:
877174-38-4
Molecular Formula:
C22H26O6
Molecular Weight:
386.4382
IUPAC Name:
4-[6-(3-formyl-5-methoxyphenoxy)hexoxy]-3-methoxybenzaldehyde
InChI:
InChI=1S/C22H26O6/c1-25-19-11-18(16-24)12-20(14-19)27-9-5-3-4-6-10-28-21-8-7-17(15-23)13-22(21)26-2/h7-8,11-16H,3-6,9-10H2,1-2H3
InChI Key:
KOTAQJNNWCDCSX-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)OC)OCCCCCCOc1cc(OC)cc(c1)C=O
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.173g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
386.444g/mol
Monoisotopic Mass:
386.173g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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