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Home > Fluorides > 1190321-48-2
1190321-48-2 | 2H-Pyrrolo[2,3-b]pyridin-2-one, 4-fluoro-1,3-dihydro-6-methoxy-
CAS No: 1190321-48-2 Catalog No: AG000HYR MDL No:
Product Description
Catalog Number:
AG000HYR
Chemical Name:
2H-Pyrrolo[2,3-b]pyridin-2-one, 4-fluoro-1,3-dihydro-6-methoxy-
CAS Number:
1190321-48-2
Molecular Formula:
C8H7FN2O2
Molecular Weight:
182.1518
IUPAC Name:
4-fluoro-6-methoxy-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
InChI:
InChI=1S/C8H7FN2O2/c1-13-7-3-5(9)4-2-6(12)10-8(4)11-7/h3H,2H2,1H3,(H,10,11,12)
InChI Key:
JUUAWSNBMXCNJJ-UHFFFAOYSA-N
SMILES:
COc1cc(F)c2c(n1)NC(=O)C2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.049g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.154g/mol
Monoisotopic Mass:
182.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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