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101653-61-6 | Diazene, 1,2-bis[4-(phenylmethoxy)phenyl]-, 1-oxide
CAS No: 101653-61-6 Catalog No: AG00053Q MDL No:
Product Description
Catalog Number:
AG00053Q
Chemical Name:
Diazene, 1,2-bis[4-(phenylmethoxy)phenyl]-, 1-oxide
CAS Number:
101653-61-6
Molecular Formula:
C26H22N2O3
Molecular Weight:
410.4645
IUPAC Name:
oxido-(4-phenylmethoxyphenyl)-(4-phenylmethoxyphenyl)iminoazanium
InChI:
InChI=1S/C26H22N2O3/c29-28(24-13-17-26(18-14-24)31-20-22-9-5-2-6-10-22)27-23-11-15-25(16-12-23)30-19-21-7-3-1-4-8-21/h1-18H,19-20H2
InChI Key:
DTVAGUHRKUDZLI-UHFFFAOYSA-N
SMILES:
[O-][N+](=Nc1ccc(cc1)OCc1ccccc1)c1ccc(cc1)OCc1ccccc1
Properties
Complexity:
527
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
410.163g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
410.473g/mol
Monoisotopic Mass:
410.163g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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