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1214327-70-4 | 4-Pyridinol, 3-chloro-5-fluoro-
CAS No: 1214327-70-4 Catalog No: AG0014RL MDL No:
Product Description
Catalog Number:
AG0014RL
Chemical Name:
4-Pyridinol, 3-chloro-5-fluoro-
CAS Number:
1214327-70-4
Molecular Formula:
C5H3ClFNO
Molecular Weight:
147.5348
IUPAC Name:
3-chloro-5-fluoro-1H-pyridin-4-one
InChI:
InChI=1S/C5H3ClFNO/c6-3-1-8-2-4(7)5(3)9/h1-2H,(H,8,9)
InChI Key:
LQDLGASBADTRCC-UHFFFAOYSA-N
SMILES:
Oc1c(F)cncc1Cl
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.989g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
147.533g/mol
Monoisotopic Mass:
146.989g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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