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Home > Fluorides > 1246088-53-8
1246088-53-8 | 1H-Pyrrolo[2,3-b]pyridine-4-methanol, 5-fluoro-
CAS No: 1246088-53-8 Catalog No: AG000MGC MDL No:MFCD17171331
Product Description
Catalog Number:
AG000MGC
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-4-methanol, 5-fluoro-
CAS Number:
1246088-53-8
Molecular Formula:
C8H7FN2O
Molecular Weight:
166.1524
MDL Number:
MFCD17171331
IUPAC Name:
(5-fluoro-1H-pyrrolo[2,3-b]pyridin-4-yl)methanol
InChI:
InChI=1S/C8H7FN2O/c9-7-3-11-8-5(1-2-10-8)6(7)4-12/h1-3,12H,4H2,(H,10,11)
InChI Key:
WTEOTZYPQUTLNZ-UHFFFAOYSA-N
SMILES:
OCc1c(F)cnc2c1cc[nH]2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.054g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
166.155g/mol
Monoisotopic Mass:
166.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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