Home Halogens 1H-Pyrazolo[4,3-b]pyridine-3-carboxylic acid, 6-chloro-, ethyl ester

1H-Pyrazolo[4,3-b]pyridine-3-carboxylic acid, 6-chloro-, ethyl ester

CAS No.:
1363380-62-4
Catalog Number:
AG0011NP
Molecular Formula:
C9H8ClN3O2
Molecular Weight:
225.6317
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Product Description
Catalog Number:
AG0011NP
Chemical Name:
1H-Pyrazolo[4,3-b]pyridine-3-carboxylic acid, 6-chloro-, ethyl ester
CAS Number:
1363380-62-4
Molecular Formula:
C9H8ClN3O2
Molecular Weight:
225.6317
MDL Number:
MFCD21642076
IUPAC Name:
ethyl 6-chloro-1H-pyrazolo[4,3-b]pyridine-3-carboxylate
InChI:
InChI=1S/C9H8ClN3O2/c1-2-15-9(14)8-7-6(12-13-8)3-5(10)4-11-7/h3-4H,2H2,1H3,(H,12,13)
InChI Key:
CZOQCLRXLRTRLX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1n[nH]c2c1ncc(c2)Cl
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.031g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.632g/mol
Monoisotopic Mass:
225.031g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties