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1268520-92-8 | 1H-Pyrazolo[3,4-b]pyridine, 4-chloro-1-methyl-
CAS No: 1268520-92-8 Catalog No: AG000TCK MDL No:MFCD17011807
Product Description
Catalog Number:
AG000TCK
Chemical Name:
1H-Pyrazolo[3,4-b]pyridine, 4-chloro-1-methyl-
CAS Number:
1268520-92-8
Molecular Formula:
C7H6ClN3
Molecular Weight:
167.5956
MDL Number:
MFCD17011807
IUPAC Name:
4-chloro-1-methylpyrazolo[3,4-b]pyridine
InChI:
InChI=1S/C7H6ClN3/c1-11-7-5(4-10-11)6(8)2-3-9-7/h2-4H,1H3
InChI Key:
XYCQHBVGJNXHGP-UHFFFAOYSA-N
SMILES:
Clc1ccnc2c1cnn2C
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.596g/mol
Monoisotopic Mass:
167.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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