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Home > Other Heterocycles > 88046-52-0
88046-52-0 | Bicyclo[4.3.2]undecane-2,11-dione
CAS No: 88046-52-0 Catalog No: AG004IXK MDL No:
Product Description
Catalog Number:
AG004IXK
Chemical Name:
Bicyclo[4.3.2]undecane-2,11-dione
CAS Number:
88046-52-0
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
IUPAC Name:
bicyclo[4.3.2]undecane-2,11-dione
InChI:
InChI=1S/C11H16O2/c12-10-6-2-4-8-3-1-5-9(10)7-11(8)13/h8-9H,1-7H2
InChI Key:
TWXLWNIZXYAYSV-UHFFFAOYSA-N
SMILES:
O=C1CCCC2C(=O)CC1CCC2
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.247g/mol
Monoisotopic Mass:
180.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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