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1260765-26-1 | 1H-Pyrazole-3-carboxylic acid, 4-(2-pyridinyl)-
CAS No: 1260765-26-1 Catalog No: AG000R6Q MDL No:MFCD16659683
Product Description
Catalog Number:
AG000R6Q
Chemical Name:
1H-Pyrazole-3-carboxylic acid, 4-(2-pyridinyl)-
CAS Number:
1260765-26-1
Molecular Formula:
C9H7N3O2
Molecular Weight:
189.1708
MDL Number:
MFCD16659683
IUPAC Name:
4-pyridin-2-yl-1H-pyrazole-5-carboxylic acid
InChI:
InChI=1S/C9H7N3O2/c13-9(14)8-6(5-11-12-8)7-3-1-2-4-10-7/h1-5H,(H,11,12)(H,13,14)
InChI Key:
HJVKSEDQRMTXQK-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]cc1c1ccccn1
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.054g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
189.174g/mol
Monoisotopic Mass:
189.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Multicomponent assembly of anionic and neutral decanuclear copper(II) phosphonate cages. | Inorganic chemistry 20120521 |
| From simple to complex: topological evolution and luminescence variation in a copper(I) pyridylpyrazolate system tuned via second ligating spacers. | Inorganic chemistry 20110919 |
| Blue-emitting platinum(II) complexes bearing both pyridylpyrazolate chelate and bridging pyrazolate ligands: synthesis, structures, and photophysical properties. | Inorganic chemistry 20071224 |
| Interplay between intra- and interligand charge transfer with variation of the axial N-heterocyclic ligand in osmium(II) pyridylpyrazolate complexes: extensive color tuning by phosphorescent solvatochromism. | Chemistry (Weinheim an der Bergstrasse, Germany) 20051021 |
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