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89508-65-6 | Pyrimidine, 2-[1,1'-biphenyl]-4-yl-4,6-dichloro-
CAS No: 89508-65-6 Catalog No: AG0041EE MDL No:
Product Description
Catalog Number:
AG0041EE
Chemical Name:
Pyrimidine, 2-[1,1'-biphenyl]-4-yl-4,6-dichloro-
CAS Number:
89508-65-6
Molecular Formula:
C16H10Cl2N2
Molecular Weight:
301.1700
IUPAC Name:
4,6-dichloro-2-(4-phenylphenyl)pyrimidine
InChI:
InChI=1S/C16H10Cl2N2/c17-14-10-15(18)20-16(19-14)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-10H
InChI Key:
XGLURXDMKXERQK-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)nc(n1)c1ccc(cc1)c1ccccc1
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.022g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.17g/mol
Monoisotopic Mass:
300.022g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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