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1788054-70-5 | 1H-Pyrazolo[3,4-b]pyridine-3-methanamine, 1-methyl-, hydrochloride (1:1)
CAS No: 1788054-70-5 Catalog No: AG0026DA MDL No:MFCD28501209
Product Description
Catalog Number:
AG0026DA
Chemical Name:
1H-Pyrazolo[3,4-b]pyridine-3-methanamine, 1-methyl-, hydrochloride (1:1)
CAS Number:
1788054-70-5
Molecular Formula:
C8H11ClN4
Molecular Weight:
198.6527
MDL Number:
MFCD28501209
IUPAC Name:
(1-methylpyrazolo[3,4-b]pyridin-3-yl)methanamine;hydrochloride
InChI:
InChI=1S/C8H10N4.ClH/c1-12-8-6(3-2-4-10-8)7(5-9)11-12;/h2-4H,5,9H2,1H3;1H
InChI Key:
VKEOPIMHKBQENM-UHFFFAOYSA-N
SMILES:
Cn1nc(c2c1nccc2)CN.Cl
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
198.654g/mol
Monoisotopic Mass:
198.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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