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Home > Other Heterocycles > 1820686-49-4
1820686-49-4 | (1R,3r,5S)-3-(Pyrimidin-2-yloxy)-8-azabicyclo[3.2.1]octane dihydrochloride
CAS No: 1820686-49-4 Catalog No: AG01FMMK MDL No:MFCD28369993
Product Description
Catalog Number:
AG01FMMK
Chemical Name:
(1R,3r,5S)-3-(Pyrimidin-2-yloxy)-8-azabicyclo[3.2.1]octane dihydrochloride
CAS Number:
1820686-49-4
Molecular Formula:
C11H17Cl2N3O
Molecular Weight:
278.1782
MDL Number:
MFCD28369993
IUPAC Name:
3-pyrimidin-2-yloxy-8-azabicyclo[3.2.1]octane;dihydrochloride
InChI:
InChI=1S/C11H15N3O.2ClH/c1-4-12-11(13-5-1)15-10-6-8-2-3-9(7-10)14-8;;/h1,4-5,8-10,14H,2-3,6-7H2;2*1H
InChI Key:
ZZJKIPBIZYXDRQ-UHFFFAOYSA-N
SMILES:
C1CC2NC1CC(C2)Oc1ncccn1.Cl.Cl
Properties
Complexity:
206
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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