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Home > Pyridines > 833458-52-9
833458-52-9 | 3H-Pyrazolo[3,4-b]pyridine, 3-(3-cyclopenten-1-yl)-
CAS No: 833458-52-9 Catalog No: AG004SFB MDL No:
Product Description
Catalog Number:
AG004SFB
Chemical Name:
3H-Pyrazolo[3,4-b]pyridine, 3-(3-cyclopenten-1-yl)-
CAS Number:
833458-52-9
Molecular Formula:
C11H11N3
Molecular Weight:
185.2251
IUPAC Name:
3-cyclopent-3-en-1-yl-3H-pyrazolo[3,4-b]pyridine
InChI:
InChI=1S/C11H11N3/c1-2-5-8(4-1)10-9-6-3-7-12-11(9)14-13-10/h1-3,6-8,10H,4-5H2
InChI Key:
GEJPJXPVXHECCW-UHFFFAOYSA-N
SMILES:
C1=CCC(C1)C1N=Nc2c1cccn2
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.23g/mol
Monoisotopic Mass:
185.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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