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1167056-17-8 | Pyrazolo[1,5-a]pyridine-3-carboxylic acid, 4-chloro-
CAS No: 1167056-17-8 Catalog No: AG000D2B MDL No:MFCD12405123
Product Description
Catalog Number:
AG000D2B
Chemical Name:
Pyrazolo[1,5-a]pyridine-3-carboxylic acid, 4-chloro-
CAS Number:
1167056-17-8
Molecular Formula:
C8H5ClN2O2
Molecular Weight:
196.5905
MDL Number:
MFCD12405123
IUPAC Name:
4-chloropyrazolo[1,5-a]pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H5ClN2O2/c9-6-2-1-3-11-7(6)5(4-10-11)8(12)13/h1-4H,(H,12,13)
InChI Key:
DQRAKKBKMSWGGH-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnn2c1c(Cl)ccc2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.004g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.59g/mol
Monoisotopic Mass:
196.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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