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850559-54-5 | [1,1':4',1''-Terphenyl]-4,4''-dicarboxaldehyde, 2',3',5',6'-tetramethyl-
CAS No: 850559-54-5 Catalog No: AG004PCL MDL No:
Product Description
Catalog Number:
AG004PCL
Chemical Name:
[1,1':4',1''-Terphenyl]-4,4''-dicarboxaldehyde, 2',3',5',6'-tetramethyl-
CAS Number:
850559-54-5
Molecular Formula:
C24H22O2
Molecular Weight:
342.4303
IUPAC Name:
4-[4-(4-formylphenyl)-2,3,5,6-tetramethylphenyl]benzaldehyde
InChI:
InChI=1S/C24H22O2/c1-15-16(2)24(22-11-7-20(14-26)8-12-22)18(4)17(3)23(15)21-9-5-19(13-25)6-10-21/h5-14H,1-4H3
InChI Key:
SOGBYRYNMDXUPO-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1c(C)c(C)c(c(c1C)C)c1ccc(cc1)C=O
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.162g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.438g/mol
Monoisotopic Mass:
342.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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