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Home > Fluorides > 1286263-43-1
1286263-43-1 | 2-Fluoro-6-nitro-N-(piperidin-4-ylmethyl)aniline hydrochloride
CAS No: 1286263-43-1 Catalog No: AG01F65O MDL No:
Product Description
Catalog Number:
AG01F65O
Chemical Name:
2-Fluoro-6-nitro-N-(piperidin-4-ylmethyl)aniline hydrochloride
CAS Number:
1286263-43-1
Molecular Formula:
C12H17ClFN3O2
Molecular Weight:
289.7337
IUPAC Name:
2-fluoro-6-nitro-N-(piperidin-4-ylmethyl)aniline;hydrochloride
InChI:
InChI=1S/C12H16FN3O2.ClH/c13-10-2-1-3-11(16(17)18)12(10)15-8-9-4-6-14-7-5-9;/h1-3,9,14-15H,4-8H2;1H
InChI Key:
BKYJCPRCDNGQDS-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1NCC1CCNCC1)[N+](=O)[O-].Cl
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.099g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
289.735g/mol
Monoisotopic Mass:
289.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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