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Home > Other Heterocycles > 81640-32-6
81640-32-6 | 1,5-DIMETHYLBICYCLO[3.1.0]HEXANE-2,3,4-TRIONE
CAS No: 81640-32-6 Catalog No: AG0051LA MDL No:
Product Description
Catalog Number:
AG0051LA
Chemical Name:
1,5-DIMETHYLBICYCLO[3.1.0]HEXANE-2,3,4-TRIONE
CAS Number:
81640-32-6
Molecular Formula:
C8H8O3
Molecular Weight:
152.1473
IUPAC Name:
1,5-dimethylbicyclo[3.1.0]hexane-2,3,4-trione
InChI:
InChI=1S/C8H8O3/c1-7-3-8(7,2)6(11)4(9)5(7)10/h3H2,1-2H3
InChI Key:
ILUAVTSUMQJWCW-UHFFFAOYSA-N
SMILES:
O=C1C(=O)C2(C(C1=O)(C2)C)C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.047g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.149g/mol
Monoisotopic Mass:
152.047g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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