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Home > Fluorides > 1170364-71-2
1170364-71-2 | Piperidine, 2-[(3-fluoro-4-methoxyphenyl)methyl]-, hydrochloride (1:1)
CAS No: 1170364-71-2 Catalog No: AG000DLQ MDL No:
Product Description
Catalog Number:
AG000DLQ
Chemical Name:
Piperidine, 2-[(3-fluoro-4-methoxyphenyl)methyl]-, hydrochloride (1:1)
CAS Number:
1170364-71-2
Molecular Formula:
C13H19ClFNO
Molecular Weight:
259.7475
IUPAC Name:
2-[(3-fluoro-4-methoxyphenyl)methyl]piperidine;hydrochloride
InChI:
InChI=1S/C13H18FNO.ClH/c1-16-13-6-5-10(9-12(13)14)8-11-4-2-3-7-15-11;/h5-6,9,11,15H,2-4,7-8H2,1H3;1H
InChI Key:
MXUIXMWQPZZGDH-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)CC1CCCCN1.Cl
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.114g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
259.749g/mol
Monoisotopic Mass:
259.114g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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