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87730-61-8 | 5-(4-ethoxyphenyl)diazenyl-2-phenylmethoxy-benzaldehyde
CAS No: 87730-61-8 Catalog No: AG004MYI MDL No:
Product Description
Catalog Number:
AG004MYI
Chemical Name:
5-(4-ethoxyphenyl)diazenyl-2-phenylmethoxy-benzaldehyde
CAS Number:
87730-61-8
Molecular Formula:
C22H20N2O3
Molecular Weight:
360.4058
IUPAC Name:
5-[(4-ethoxyphenyl)diazenyl]-2-phenylmethoxybenzaldehyde
InChI:
InChI=1S/C22H20N2O3/c1-2-26-21-11-8-19(9-12-21)23-24-20-10-13-22(18(14-20)15-25)27-16-17-6-4-3-5-7-17/h3-15H,2,16H2,1H3
InChI Key:
QMIMWGVGEBXJBU-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)N=Nc1ccc(c(c1)C=O)OCc1ccccc1
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.147g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
360.413g/mol
Monoisotopic Mass:
360.147g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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