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1219980-98-9 | 3-(4-Fluoro-benzyloxy)-piperidine hydrochloride
CAS No: 1219980-98-9 Catalog No: AG01F9R2 MDL No:
Product Description
Catalog Number:
AG01F9R2
Chemical Name:
3-(4-Fluoro-benzyloxy)-piperidine hydrochloride
CAS Number:
1219980-98-9
Molecular Formula:
C12H17ClFNO
Molecular Weight:
245.7209
IUPAC Name:
3-[(4-fluorophenyl)methoxy]piperidine;hydrochloride
InChI:
InChI=1S/C12H16FNO.ClH/c13-11-5-3-10(4-6-11)9-15-12-2-1-7-14-8-12;/h3-6,12,14H,1-2,7-9H2;1H
InChI Key:
SYUAJBBFHSPWHD-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)COC1CCCNC1.Cl
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.098g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
245.722g/mol
Monoisotopic Mass:
245.098g/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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