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Home > Other Heterocycles > 17660-74-1
17660-74-1 | Bicyclo[2.2.2]oct-7-ene-2,5-dione
CAS No: 17660-74-1 Catalog No: AG0024SL MDL No:
Product Description
Catalog Number:
AG0024SL
Chemical Name:
Bicyclo[2.2.2]oct-7-ene-2,5-dione
CAS Number:
17660-74-1
Molecular Formula:
C8H8O2
Molecular Weight:
136.1479
IUPAC Name:
bicyclo[2.2.2]oct-7-ene-2,5-dione
InChI:
InChI=1S/C8H8O2/c9-7-4-6-2-1-5(7)3-8(6)10/h1-2,5-6H,3-4H2
InChI Key:
RLWFLNMCQMZCJQ-UHFFFAOYSA-N
SMILES:
O=C1CC2C=CC1CC2=O
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.052g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.15g/mol
Monoisotopic Mass:
136.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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