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87997-32-8 | Benzaldehyde, 5-methoxy-2,3,4-tris(phenylmethoxy)-
CAS No: 87997-32-8 Catalog No: AG004KO7 MDL No:
Product Description
Catalog Number:
AG004KO7
Chemical Name:
Benzaldehyde, 5-methoxy-2,3,4-tris(phenylmethoxy)-
CAS Number:
87997-32-8
Molecular Formula:
C29H26O5
Molecular Weight:
454.5137
IUPAC Name:
5-methoxy-2,3,4-tris(phenylmethoxy)benzaldehyde
InChI:
InChI=1S/C29H26O5/c1-31-26-17-25(18-30)27(32-19-22-11-5-2-6-12-22)29(34-21-24-15-9-4-10-16-24)28(26)33-20-23-13-7-3-8-14-23/h2-18H,19-21H2,1H3
InChI Key:
DUBDTGAKSYDNCI-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c(c(c1OCc1ccccc1)OCc1ccccc1)OCc1ccccc1
Properties
Complexity:
565
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
454.178g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
454.522g/mol
Monoisotopic Mass:
454.178g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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