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1260890-41-2 | 2-Pyridinecarboxylic acid, 3-fluoro-, hydrochloride (1:1)
CAS No: 1260890-41-2 Catalog No: AG000RIS MDL No:MFCD11041011
Product Description
Catalog Number:
AG000RIS
Chemical Name:
2-Pyridinecarboxylic acid, 3-fluoro-, hydrochloride (1:1)
CAS Number:
1260890-41-2
Molecular Formula:
C6H5ClFNO2
Molecular Weight:
177.5608
MDL Number:
MFCD11041011
IUPAC Name:
3-fluoropyridine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H4FNO2.ClH/c7-4-2-1-3-8-5(4)6(9)10;/h1-3H,(H,9,10);1H
InChI Key:
GNVUBIWUTPVIOY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncccc1F.Cl
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.999g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.559g/mol
Monoisotopic Mass:
176.999g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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