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Home > Other Heterocycles > 1087789-16-9
1087789-16-9 | 3-(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-one
CAS No: 1087789-16-9 Catalog No: AG01A8FV MDL No:MFCD13806424
Product Description
Catalog Number:
AG01A8FV
Chemical Name:
3-(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-one
CAS Number:
1087789-16-9
Molecular Formula:
C10H17NO
Molecular Weight:
167.2481
MDL Number:
MFCD13806424
IUPAC Name:
3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-one
InChI:
InChI=1S/C10H17NO/c1-7(2)11-5-8-3-4-9(6-11)10(8)12/h7-9H,3-6H2,1-2H3
InChI Key:
PKRSHJSQEQZFSE-UHFFFAOYSA-N
SMILES:
CC(N1CC2CCC(C1)C2=O)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.252g/mol
Monoisotopic Mass:
167.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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