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87367-64-4 | Benzaldehyde,4,4'-[1,9-nonanediylbis(oxy)]bis-
CAS No: 87367-64-4 Catalog No: AG004KOT MDL No:
Product Description
Catalog Number:
AG004KOT
Chemical Name:
Benzaldehyde,4,4'-[1,9-nonanediylbis(oxy)]bis-
CAS Number:
87367-64-4
Molecular Formula:
C23H28O4
Molecular Weight:
368.4660
IUPAC Name:
4-[9-(4-formylphenoxy)nonoxy]benzaldehyde
InChI:
InChI=1S/C23H28O4/c24-18-20-8-12-22(13-9-20)26-16-6-4-2-1-3-5-7-17-27-23-14-10-21(19-25)11-15-23/h8-15,18-19H,1-7,16-17H2
InChI Key:
WFSYRCWVQZEUTJ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OCCCCCCCCCOc1ccc(cc1)C=O
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.199g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.473g/mol
Monoisotopic Mass:
368.199g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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