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1588976-99-1 | 1H-Pyrazolo[4,3-c]pyridine, 6-chloro-3-methoxy-
CAS No: 1588976-99-1 Catalog No: AG001QZH MDL No:
Product Description
Catalog Number:
AG001QZH
Chemical Name:
1H-Pyrazolo[4,3-c]pyridine, 6-chloro-3-methoxy-
CAS Number:
1588976-99-1
Molecular Formula:
C7H6ClN3O
Molecular Weight:
183.5950
IUPAC Name:
6-chloro-3-methoxy-1H-pyrazolo[4,3-c]pyridine
InChI:
InChI=1S/C7H6ClN3O/c1-12-7-4-3-9-6(8)2-5(4)10-11-7/h2-3H,1H3,(H,10,11)
InChI Key:
LLZKMYHXZVFGMK-UHFFFAOYSA-N
SMILES:
COc1n[nH]c2c1cnc(c2)Cl
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.595g/mol
Monoisotopic Mass:
183.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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