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1255860-55-9 | Isoquinoline, 6-(4-pyridinyl)-
CAS No: 1255860-55-9 Catalog No: AG00IM8M MDL No:
Product Description
Catalog Number:
AG00IM8M
Chemical Name:
Isoquinoline, 6-(4-pyridinyl)-
CAS Number:
1255860-55-9
Molecular Formula:
C14H10N2
Molecular Weight:
206.2426
IUPAC Name:
6-pyridin-4-ylisoquinoline
InChI:
InChI=1S/C14H10N2/c1-2-14-10-16-8-5-13(14)9-12(1)11-3-6-15-7-4-11/h1-10H
InChI Key:
SOMUJVWZPGYIFI-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)c1ccc2c(c1)ccnc2
Properties
Complexity:
223
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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