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Home > Fluorides > 1286272-66-9
1286272-66-9 | 4-[(3-Fluoro-2-nitrophenoxy)methyl]piperidine hydrochloride
CAS No: 1286272-66-9 Catalog No: AG01F6TZ MDL No:
Product Description
Catalog Number:
AG01F6TZ
Chemical Name:
4-[(3-Fluoro-2-nitrophenoxy)methyl]piperidine hydrochloride
CAS Number:
1286272-66-9
Molecular Formula:
C12H16ClFN2O3
Molecular Weight:
290.7184
IUPAC Name:
4-[(3-fluoro-2-nitrophenoxy)methyl]piperidine;hydrochloride
InChI:
InChI=1S/C12H15FN2O3.ClH/c13-10-2-1-3-11(12(10)15(16)17)18-8-9-4-6-14-7-5-9;/h1-3,9,14H,4-8H2;1H
InChI Key:
MLDLJJGWAZHLHW-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1[N+](=O)[O-])OCC1CCNCC1.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:
290.083g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
290.719g/mol
Monoisotopic Mass:
290.083g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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