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Home > Other Heterocycles > 31996-68-6
31996-68-6 | bicyclo[4.2.0]oct-2-en-7-one
CAS No: 31996-68-6 Catalog No: AG01DWC2 MDL No:MFCD24688886
Product Description
Catalog Number:
AG01DWC2
Chemical Name:
bicyclo[4.2.0]oct-2-en-7-one
CAS Number:
31996-68-6
Molecular Formula:
C8H10O
Molecular Weight:
122.1644
MDL Number:
MFCD24688886
IUPAC Name:
bicyclo[4.2.0]oct-2-en-7-one
InChI:
InChI=1S/C8H10O/c9-8-5-6-3-1-2-4-7(6)8/h1,3,6-7H,2,4-5H2
InChI Key:
JKLZCTYQZFXPSW-UHFFFAOYSA-N
SMILES:
O=C1CC2C1CCC=C2
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.073g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.167g/mol
Monoisotopic Mass:
122.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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