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Home > Aldehydes > 1256785-09-7
1256785-09-7 | 1H-Pyrazolo[3,4-b]pyridine-3-carboxaldehyde, 5-fluoro-
CAS No: 1256785-09-7 Catalog No: AG000OCQ MDL No:MFCD18261245
Product Description
Catalog Number:
AG000OCQ
Chemical Name:
1H-Pyrazolo[3,4-b]pyridine-3-carboxaldehyde, 5-fluoro-
CAS Number:
1256785-09-7
Molecular Formula:
C7H4FN3O
Molecular Weight:
165.1246
MDL Number:
MFCD18261245
IUPAC Name:
5-fluoro-2H-pyrazolo[3,4-b]pyridine-3-carbaldehyde
InChI:
InChI=1S/C7H4FN3O/c8-4-1-5-6(3-12)10-11-7(5)9-2-4/h1-3H,(H,9,10,11)
InChI Key:
XXWYUZZHWWDYPU-UHFFFAOYSA-N
SMILES:
O=Cc1n[nH]c2c1cc(F)cn2
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.034g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.127g/mol
Monoisotopic Mass:
165.034g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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