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84509-26-2 | 8,10-Dioxa-3-azabicyclo(5.2.1)decane, 7-(4-fluorophenyl)-, hydrochloride
CAS No: 84509-26-2 Catalog No: AG0054M4 MDL No:
Product Description
Catalog Number:
AG0054M4
Chemical Name:
8,10-Dioxa-3-azabicyclo(5.2.1)decane, 7-(4-fluorophenyl)-, hydrochloride
CAS Number:
84509-26-2
Molecular Formula:
C13H17ClFNO2
Molecular Weight:
273.7310
IUPAC Name:
7-(4-fluorophenyl)-8,10-dioxa-3-azabicyclo[5.2.1]decane;hydrochloride
InChI:
InChI=1S/C13H16FNO2.ClH/c14-11-4-2-10(3-5-11)13-6-1-7-15-8-12(17-13)9-16-13;/h2-5,12,15H,1,6-9H2;1H
InChI Key:
FYTCVBQEZILHEA-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C12CCCNCC(O2)CO1.Cl
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.093g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
273.732g/mol
Monoisotopic Mass:
273.093g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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