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27080-08-6 | 4,4'-Biquinoline
CAS No: 27080-08-6 Catalog No: AG007LWY MDL No:
Product Description
Catalog Number:
AG007LWY
Chemical Name:
4,4'-Biquinoline
CAS Number:
27080-08-6
Molecular Formula:
C18H12N2
Molecular Weight:
256.3013
IUPAC Name:
4-quinolin-4-ylquinoline
InChI:
InChI=1S/C18H12N2/c1-3-7-17-15(5-1)13(9-11-19-17)14-10-12-20-18-8-4-2-6-16(14)18/h1-12H
InChI Key:
MVWFINKRIQNHGG-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c(ccn2)c1ccnc2c1cccc2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.1g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.308g/mol
Monoisotopic Mass:
256.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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