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83871-65-2 | 1,2-Ethanediamine, 1,2-bis(4-methoxyphenyl)-N,N'-diphenyl-
CAS No: 83871-65-2 Catalog No: AG004VGQ MDL No:
Product Description
Catalog Number:
AG004VGQ
Chemical Name:
1,2-Ethanediamine, 1,2-bis(4-methoxyphenyl)-N,N'-diphenyl-
CAS Number:
83871-65-2
Molecular Formula:
C28H28N2O2
Molecular Weight:
424.5341
IUPAC Name:
1,2-bis(4-methoxyphenyl)-N,N'-diphenylethane-1,2-diamine
InChI:
InChI=1S/C28H28N2O2/c1-31-25-17-13-21(14-18-25)27(29-23-9-5-3-6-10-23)28(30-24-11-7-4-8-12-24)22-15-19-26(32-2)20-16-22/h3-20,27-30H,1-2H3
InChI Key:
XLPUGNMFPTVVIJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(C(c1ccc(cc1)OC)Nc1ccccc1)Nc1ccccc1
Properties
Complexity:
456
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
424.215g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
424.544g/mol
Monoisotopic Mass:
424.215g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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