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Home > Fluorides > 1309602-71-8
1309602-71-8 | 4-Pyridinol, 3-fluoro-, hydrochloride (1:1)
CAS No: 1309602-71-8 Catalog No: AG000V5Y MDL No:MFCD19442154
Product Description
Catalog Number:
AG000V5Y
Chemical Name:
4-Pyridinol, 3-fluoro-, hydrochloride (1:1)
CAS Number:
1309602-71-8
Molecular Formula:
C5H5ClFNO
Molecular Weight:
149.5507
MDL Number:
MFCD19442154
IUPAC Name:
3-fluoro-1H-pyridin-4-one;hydrochloride
InChI:
InChI=1S/C5H4FNO.ClH/c6-4-3-7-2-1-5(4)8;/h1-3H,(H,7,8);1H
InChI Key:
KSQMXSHDQWGUCK-UHFFFAOYSA-N
SMILES:
Oc1ccncc1F.Cl
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.004g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.549g/mol
Monoisotopic Mass:
149.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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