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112370-16-8 | 4-Pyridin-2-yl-isoquinoline
CAS No: 112370-16-8 Catalog No: AG01FFCR MDL No:
Product Description
Catalog Number:
AG01FFCR
Chemical Name:
4-Pyridin-2-yl-isoquinoline
CAS Number:
112370-16-8
Molecular Formula:
C14H10N2
Molecular Weight:
206.2426
IUPAC Name:
4-pyridin-2-ylisoquinoline
InChI:
InChI=1S/C14H10N2/c1-2-6-12-11(5-1)9-15-10-13(12)14-7-3-4-8-16-14/h1-10H
InChI Key:
MMZHUJNATIRHPO-UHFFFAOYSA-N
SMILES:
c1ccc(nc1)c1cncc2c1cccc2
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.084g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.248g/mol
Monoisotopic Mass:
206.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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