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Home > Fluorides > 1190315-65-1
1190315-65-1 | 1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-4-nitro-
CAS No: 1190315-65-1 Catalog No: AG000HOR MDL No:
Product Description
Catalog Number:
AG000HOR
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-4-nitro-
CAS Number:
1190315-65-1
Molecular Formula:
C7H4FN3O2
Molecular Weight:
181.1240
IUPAC Name:
5-fluoro-4-nitro-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C7H4FN3O2/c8-5-3-10-7-4(1-2-9-7)6(5)11(12)13/h1-3H,(H,9,10)
InChI Key:
KHGHQQCABUPDGX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(F)cnc2c1cc[nH]2
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.029g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.126g/mol
Monoisotopic Mass:
181.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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