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Home > Other Heterocycles > 1354381-33-1
1354381-33-1 | rac-(1R,5S)-6-azabicyclo[3.2.1]octan-7-one
CAS No: 1354381-33-1 Catalog No: AG01EE7A MDL No:MFCD00213762
Product Description
Catalog Number:
AG01EE7A
Chemical Name:
rac-(1R,5S)-6-azabicyclo[3.2.1]octan-7-one
CAS Number:
1354381-33-1
Molecular Formula:
C7H11NO
Molecular Weight:
125.1683
MDL Number:
MFCD00213762
IUPAC Name:
(1R,5S)-6-azabicyclo[3.2.1]octan-7-one
InChI:
InChI=1S/C7H11NO/c9-7-5-2-1-3-6(4-5)8-7/h5-6H,1-4H2,(H,8,9)/t5-,6+/m1/s1
InChI Key:
BRGPSZFYMOKYSJ-RITPCOANSA-N
SMILES:
O=C1N[C@@H]2C[C@H]1CCC2
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
125.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.171g/mol
Monoisotopic Mass:
125.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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