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1256824-57-3 | 3-(PROPAN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBALDEHYDE
CAS No: 1256824-57-3 Catalog No: AG01BT4Z MDL No:MFCD18260544
Product Description
Catalog Number:
AG01BT4Z
Chemical Name:
3-(PROPAN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBALDEHYDE
CAS Number:
1256824-57-3
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
MDL Number:
MFCD18260544
IUPAC Name:
3-propan-2-yl-2H-pyrazolo[3,4-b]pyridine-5-carbaldehyde
InChI:
InChI=1S/C10H11N3O/c1-6(2)9-8-3-7(5-14)4-11-10(8)13-12-9/h3-6H,1-2H3,(H,11,12,13)
InChI Key:
PEWSEHIDAONALI-UHFFFAOYSA-N
SMILES:
O=Cc1cnc2c(c1)c(n[nH]2)C(C)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.218g/mol
Monoisotopic Mass:
189.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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