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100097-79-8 | 4,7-Phenanthroline, 3-(4-chlorophenyl)-1-phenyl-
CAS No: 100097-79-8 Catalog No: AG0000WI MDL No:
Product Description
Catalog Number:
AG0000WI
Chemical Name:
4,7-Phenanthroline, 3-(4-chlorophenyl)-1-phenyl-
CAS Number:
100097-79-8
Molecular Formula:
C24H15ClN2
Molecular Weight:
366.8423
IUPAC Name:
3-(4-chlorophenyl)-1-phenyl-4,7-phenanthroline
InChI:
InChI=1S/C24H15ClN2/c25-18-10-8-17(9-11-18)23-15-20(16-5-2-1-3-6-16)24-19-7-4-14-26-21(19)12-13-22(24)27-23/h1-15H
InChI Key:
DYHZYBBBDQMPFB-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1nc2ccc3c(c2c(c1)c1ccccc1)cccn3
Properties
Complexity:
483
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.092g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.848g/mol
Monoisotopic Mass:
366.092g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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