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27943-47-1

27943-47-1 | Bicyclo[2.2.1]heptane-2,5-dione

CAS No: 27943-47-1 Catalog No: AG01DESC MDL No:MFCD24445061

Product Description

Catalog Number:
AG01DESC
Chemical Name:
Bicyclo[2.2.1]heptane-2,5-dione
CAS Number:
27943-47-1
MDL Number:
MFCD24445061
IUPAC Name:
bicyclo[2.2.1]heptane-2,5-dione
InChI:
InChI=1S/C7H8O2/c8-6-2-4-1-5(6)3-7(4)9/h4-5H,1-3H2
InChI Key:
RVFBNLMXCXFOET-UHFFFAOYSA-N
NSC Number:
119479

Properties

Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.052g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.139g/mol
Monoisotopic Mass:
124.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  

Literature

Title Journal
Green's function study of the one-electron and shake-up ionization spectra of unsaturated hydrocarbon cage compounds. Journal of computational chemistry 20061115
Expanding the C2-symmetric bicyclo[2.2.1]hepta-2,5-diene ligand family: concise synthesis and catalytic activity in rhodium-catalyzed asymmetric addition. The Journal of organic chemistry 20061110
Rhodium-Catalyzed Asymmetric Conjugate Additions of Boronic Acids to enones using DIPHONANE: a novel chiral bisphosphine ligand. Organic letters 20060202
Enantioselective synthesis of DIANANE, a novel C2-symmetric chiral diamine for asymmetric catalysis. The Journal of organic chemistry 20040430
First asymmetric total synthesis of (+)-sparteine. Organic letters 20020725

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