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633328-50-4 | 1H-Pyrazolo[3,4-c]pyridine-5-carbonitrile(9CI)
CAS No: 633328-50-4 Catalog No: AG00ELX8 MDL No:MFCD13176779
Product Description
Catalog Number:
AG00ELX8
Chemical Name:
1H-Pyrazolo[3,4-c]pyridine-5-carbonitrile(9CI)
CAS Number:
633328-50-4
Molecular Formula:
C7H4N4
Molecular Weight:
144.1335
MDL Number:
MFCD13176779
IUPAC Name:
1H-pyrazolo[3,4-c]pyridine-5-carbonitrile
InChI:
InChI=1S/C7H4N4/c8-2-6-1-5-3-10-11-7(5)4-9-6/h1,3-4H,(H,10,11)
InChI Key:
MMHFIJOAWVYGEO-UHFFFAOYSA-N
SMILES:
c1c(ncc2c1cn[nH]2)C#N
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.044g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.137g/mol
Monoisotopic Mass:
144.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
65.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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