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Home > Pyridines > 1542682-85-8
1542682-85-8 | 3-(1H-PYRAZOL-1-YL)PYRIDINE-4-CARBONITRILE
CAS No: 1542682-85-8 Catalog No: AG01DVL8 MDL No:MFCD24158975
Product Description
Catalog Number:
AG01DVL8
Chemical Name:
3-(1H-PYRAZOL-1-YL)PYRIDINE-4-CARBONITRILE
CAS Number:
1542682-85-8
Molecular Formula:
C9H6N4
Molecular Weight:
170.1707
MDL Number:
MFCD24158975
IUPAC Name:
3-pyrazol-1-ylpyridine-4-carbonitrile
InChI:
InChI=1S/C9H6N4/c10-6-8-2-4-11-7-9(8)13-5-1-3-12-13/h1-5,7H
InChI Key:
BWDQRIBIXNOLKO-UHFFFAOYSA-N
SMILES:
N#Cc1ccncc1n1cccn1
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.175g/mol
Monoisotopic Mass:
170.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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