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16994-48-2 | (beta-(2-pyridyl)ethyl)isoquinoline
CAS No: 16994-48-2 Catalog No: AG00AVRH MDL No:
Product Description
Catalog Number:
AG00AVRH
Chemical Name:
(beta-(2-pyridyl)ethyl)isoquinoline
CAS Number:
16994-48-2
IUPAC Name:
1-(2-pyridin-2-ylethyl)isoquinoline
InChI:
InChI=1S/C16H14N2/c1-2-7-15-13(5-1)10-12-18-16(15)9-8-14-6-3-4-11-17-14/h1-7,10-12H,8-9H2
InChI Key:
RSBCTUPEIZFAAB-UHFFFAOYSA-N
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.302g/mol
Monoisotopic Mass:
234.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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