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Home > Aldehydes > 877775-85-4
877775-85-4 | Benzaldehyde, 4,4'-[1,3-phenylenebis(methylene)]bis-
CAS No: 877775-85-4 Catalog No: AG004KYT MDL No:
Product Description
Catalog Number:
AG004KYT
Chemical Name:
Benzaldehyde, 4,4'-[1,3-phenylenebis(methylene)]bis-
CAS Number:
877775-85-4
Molecular Formula:
C22H18O2
Molecular Weight:
314.3771
IUPAC Name:
4-[[3-[(4-formylphenyl)methyl]phenyl]methyl]benzaldehyde
InChI:
InChI=1S/C22H18O2/c23-15-19-8-4-17(5-9-19)12-21-2-1-3-22(14-21)13-18-6-10-20(16-24)11-7-18/h1-11,14-16H,12-13H2
InChI Key:
GGZYEXRGHNWTTO-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)Cc1cccc(c1)Cc1ccc(cc1)C=O
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.131g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.384g/mol
Monoisotopic Mass:
314.131g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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