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Home > Aldehydes > 2090722-23-7
2090722-23-7 | 3-ethyl-1H-pyrazolo[3,4-b]pyridine-5-carbaldehyde
CAS No: 2090722-23-7 Catalog No: AG01BT50 MDL No:MFCD30727702
Product Description
Catalog Number:
AG01BT50
Chemical Name:
3-ethyl-1H-pyrazolo[3,4-b]pyridine-5-carbaldehyde
CAS Number:
2090722-23-7
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD30727702
IUPAC Name:
3-ethyl-2H-pyrazolo[3,4-b]pyridine-5-carbaldehyde
InChI:
InChI=1S/C9H9N3O/c1-2-8-7-3-6(5-13)4-10-9(7)12-11-8/h3-5H,2H2,1H3,(H,10,11,12)
InChI Key:
GQVQRIKFEZFILJ-UHFFFAOYSA-N
SMILES:
CCc1n[nH]c2c1cc(C=O)cn2
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.075g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.191g/mol
Monoisotopic Mass:
175.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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