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Home > Pyridines > 1307248-78-7
1307248-78-7 | 3-Pyridinecarbonitrile, 2-(4-formyl-3-methyl-1H-pyrazol-1-yl)-
CAS No: 1307248-78-7 Catalog No: AG000UV6 MDL No:
Product Description
Catalog Number:
AG000UV6
Chemical Name:
3-Pyridinecarbonitrile, 2-(4-formyl-3-methyl-1H-pyrazol-1-yl)-
CAS Number:
1307248-78-7
Molecular Formula:
C11H8N4O
Molecular Weight:
212.2074
IUPAC Name:
2-(4-formyl-3-methylpyrazol-1-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C11H8N4O/c1-8-10(7-16)6-15(14-8)11-9(5-12)3-2-4-13-11/h2-4,6-7H,1H3
InChI Key:
MWHYMCRAIVRANE-UHFFFAOYSA-N
SMILES:
O=Cc1cn(nc1C)c1ncccc1C#N
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.07g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.212g/mol
Monoisotopic Mass:
212.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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