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Home > Fluorides > 1190317-16-8
1190317-16-8 | 1H-Pyrrolo[2,3-c]pyridine-3-carbonitrile, 4-fluoro-2,3-dihydro-2-oxo-
CAS No: 1190317-16-8 Catalog No: AG000HQL MDL No:
Product Description
Catalog Number:
AG000HQL
Chemical Name:
1H-Pyrrolo[2,3-c]pyridine-3-carbonitrile, 4-fluoro-2,3-dihydro-2-oxo-
CAS Number:
1190317-16-8
Molecular Formula:
C8H4FN3O
Molecular Weight:
177.1353
IUPAC Name:
4-fluoro-2-oxo-1,3-dihydropyrrolo[2,3-c]pyridine-3-carbonitrile
InChI:
InChI=1S/C8H4FN3O/c9-5-2-11-3-6-7(5)4(1-10)8(13)12-6/h2-4H,(H,12,13)
InChI Key:
WWLYMTNWDBOJBA-UHFFFAOYSA-N
SMILES:
N#CC1C(=O)Nc2c1c(F)cnc2
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.034g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.138g/mol
Monoisotopic Mass:
177.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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