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Home > Other Heterocycles > 1820705-85-8
1820705-85-8 | 3-(Pyrimidin-4-yloxy)-8-azabicyclo[3.2.1]octane dihydrochloride
CAS No: 1820705-85-8 Catalog No: AG01FMMD MDL No:MFCD29037835
Product Description
Catalog Number:
AG01FMMD
Chemical Name:
3-(Pyrimidin-4-yloxy)-8-azabicyclo[3.2.1]octane dihydrochloride
CAS Number:
1820705-85-8
Molecular Formula:
C11H17Cl2N3O
Molecular Weight:
278.1782
MDL Number:
MFCD29037835
IUPAC Name:
3-pyrimidin-4-yloxy-8-azabicyclo[3.2.1]octane;dihydrochloride
InChI:
InChI=1S/C11H15N3O.2ClH/c1-2-9-6-10(5-8(1)14-9)15-11-3-4-12-7-13-11;;/h3-4,7-10,14H,1-2,5-6H2;2*1H
InChI Key:
XMYUFNFEGLXRJM-UHFFFAOYSA-N
SMILES:
n1ccc(nc1)OC1CC2CCC(C1)N2.Cl.Cl
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
278.177g/mol
Monoisotopic Mass:
277.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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