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87999-12-0 | 5H-Indeno[1,2-b]pyridine, 4-(4-chlorophenyl)-3-phenyl-
CAS No: 87999-12-0 Catalog No: AG004NYB MDL No:
Product Description
Catalog Number:
AG004NYB
Chemical Name:
5H-Indeno[1,2-b]pyridine, 4-(4-chlorophenyl)-3-phenyl-
CAS Number:
87999-12-0
Molecular Formula:
C24H16ClN
Molecular Weight:
353.8435
IUPAC Name:
4-(4-chlorophenyl)-3-phenyl-5H-indeno[1,2-b]pyridine
InChI:
InChI=1S/C24H16ClN/c25-19-12-10-17(11-13-19)23-21-14-18-8-4-5-9-20(18)24(21)26-15-22(23)16-6-2-1-3-7-16/h1-13,15H,14H2
InChI Key:
VNSMBUGDJQNSHT-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1c(cnc2c1Cc1c2cccc1)c1ccccc1
Properties
Complexity:
465
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.097g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
353.849g/mol
Monoisotopic Mass:
353.097g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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