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Home > Fluorides > 1227268-68-9
1227268-68-9 | 1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-2,4-dimethyl-
CAS No: 1227268-68-9 Catalog No: AG000J3O MDL No:
Product Description
Catalog Number:
AG000J3O
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-2,4-dimethyl-
CAS Number:
1227268-68-9
Molecular Formula:
C9H9FN2
Molecular Weight:
164.1796
IUPAC Name:
5-fluoro-2,4-dimethyl-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C9H9FN2/c1-5-3-7-6(2)8(10)4-11-9(7)12-5/h3-4H,1-2H3,(H,11,12)
InChI Key:
KYQXYUDSZXXGLN-UHFFFAOYSA-N
SMILES:
Fc1cnc2c(c1C)cc([nH]2)C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.183g/mol
Monoisotopic Mass:
164.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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