Home Aldehydes 1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbaldehyde

1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbaldehyde

CAS No.:
1340062-44-3
Catalog Number:
AG01BXIB
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
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Product Description
Catalog Number:
AG01BXIB
Chemical Name:
1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbaldehyde
CAS Number:
1340062-44-3
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
MDL Number:
MFCD18878339
IUPAC Name:
1-methylpyrazolo[3,4-b]pyridine-5-carbaldehyde
InChI:
InChI=1S/C8H7N3O/c1-11-8-7(4-10-11)2-6(5-12)3-9-8/h2-5H,1H3
InChI Key:
LXQLWVNFWHGYNB-UHFFFAOYSA-N
SMILES:
O=Cc1cnc2c(c1)cnn2C
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.164g/mol
Monoisotopic Mass:
161.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties