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Home > Pyridines > 162435-05-4
162435-05-4 | 1-[3-(pyridin-2-yl)-1H-pyrazol-1-yl]ethan-1-one
CAS No: 162435-05-4 Catalog No: AG01AFXC MDL No:MFCD22381048
Product Description
Catalog Number:
AG01AFXC
Chemical Name:
1-[3-(pyridin-2-yl)-1H-pyrazol-1-yl]ethan-1-one
CAS Number:
162435-05-4
Molecular Formula:
C10H9N3O
Molecular Weight:
187.1980
MDL Number:
MFCD22381048
IUPAC Name:
1-(3-pyridin-2-ylpyrazol-1-yl)ethanone
InChI:
InChI=1S/C10H9N3O/c1-8(14)13-7-5-10(12-13)9-4-2-3-6-11-9/h2-7H,1H3
InChI Key:
VDVVDTCZVOULJA-UHFFFAOYSA-N
SMILES:
CC(=O)n1ccc(n1)c1ccccn1
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.075g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.202g/mol
Monoisotopic Mass:
187.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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