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70952-41-9 | Benzaldehyde, 3,3'-[[1,1'-biphenyl]-4,4'-diylbis(azo)]bis[6-hydroxy-
CAS No: 70952-41-9 Catalog No: AG005Q0S MDL No:
Product Description
Catalog Number:
AG005Q0S
Chemical Name:
Benzaldehyde, 3,3'-[[1,1'-biphenyl]-4,4'-diylbis(azo)]bis[6-hydroxy-
CAS Number:
70952-41-9
Molecular Formula:
C26H18N4O4
Molecular Weight:
450.4455
IUPAC Name:
5-[[4-[4-[(3-formyl-4-hydroxyphenyl)diazenyl]phenyl]phenyl]diazenyl]-2-hydroxybenzaldehyde
InChI:
InChI=1S/C26H18N4O4/c31-15-19-13-23(9-11-25(19)33)29-27-21-5-1-17(2-6-21)18-3-7-22(8-4-18)28-30-24-10-12-26(34)20(14-24)16-32/h1-16,33-34H
InChI Key:
GJJKOVBDRADNIH-UHFFFAOYSA-N
SMILES:
O=Cc1cc(N=Nc2ccc(cc2)c2ccc(cc2)N=Nc2ccc(c(c2)C=O)O)ccc1O
Properties
Complexity:
656
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
450.133g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
450.454g/mol
Monoisotopic Mass:
450.133g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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