200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 159726-85-9
159726-85-9 | 1,10-Phenanthroline, 2,2'-(1,3-phenylene)bis[9-(4-methoxyphenyl)-
CAS No: 159726-85-9 Catalog No: AG001RCH MDL No:
Product Description
Catalog Number:
AG001RCH
Chemical Name:
1,10-Phenanthroline, 2,2'-(1,3-phenylene)bis[9-(4-methoxyphenyl)-
CAS Number:
159726-85-9
Molecular Formula:
C44H30N4O2
Molecular Weight:
646.7346
IUPAC Name:
2-(4-methoxyphenyl)-9-[3-[9-(4-methoxyphenyl)-1,10-phenanthrolin-2-yl]phenyl]-1,10-phenanthroline
InChI:
InChI=1S/C44H30N4O2/c1-49-35-18-10-27(11-19-35)37-22-14-29-6-8-31-16-24-39(47-43(31)41(29)45-37)33-4-3-5-34(26-33)40-25-17-32-9-7-30-15-23-38(46-42(30)44(32)48-40)28-12-20-36(50-2)21-13-28/h3-26H,1-2H3
InChI Key:
DHFGUMDDFPOBPN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1ccc2c(n1)c1nc(ccc1cc2)c1cccc(c1)c1ccc2c(n1)c1nc(ccc1cc2)c1ccc(cc1)OC
Properties
Complexity:
1010
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
646.237g/mol
Formal Charge:
0
Heavy Atom Count:
50
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
646.75g/mol
Monoisotopic Mass:
646.237g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.