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Home > Other Heterocycles > 16473-11-3
16473-11-3 | Bicyclo[3.3.1]nonane-2,6-dione
CAS No: 16473-11-3 Catalog No: AG001V2N MDL No:MFCD00153926
Product Description
Catalog Number:
AG001V2N
Chemical Name:
Bicyclo[3.3.1]nonane-2,6-dione
CAS Number:
16473-11-3
Molecular Formula:
C9H12O2
Molecular Weight:
152.1904
MDL Number:
MFCD00153926
IUPAC Name:
bicyclo[3.3.1]nonane-2,6-dione
InChI:
InChI=1S/C9H12O2/c10-8-3-1-6-5-7(8)2-4-9(6)11/h6-7H,1-5H2
InChI Key:
QWNPVTXLBMSEPN-UHFFFAOYSA-N
SMILES:
O=C1CCC2CC1CCC2=O
NSC Number:
92375
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.193g/mol
Monoisotopic Mass:
152.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Synthesis and self-aggregation of enantiopure and racemic molecular tweezers based on the bicyclo[3.3.1]nonane framework. | Chemistry (Weinheim an der Bergstrasse, Germany) 20100406 |
| 2,3,10,11-Tetra-meth-oxy-6,7,14,15-tetra-hydro-6,14-methano-cyclo-octa-[1,2-b;5,6-b']diquinoline. | Acta crystallographica. Section E, Structure reports online 20080101 |
| Determination of the absolute configuration of bicyclo[3.3.1]nonane-2,7-dione by circular dichroism spectroscopy and chemical correlation. | Chirality 20010101 |
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