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Home > Other Heterocycles > 67457-54-9
67457-54-9 | 2-Oxaspiro[4.5]decane-1,3-dione, 7,8-dimethyl-
CAS No: 67457-54-9 Catalog No: AG005O3E MDL No:
Product Description
Catalog Number:
AG005O3E
Chemical Name:
2-Oxaspiro[4.5]decane-1,3-dione, 7,8-dimethyl-
CAS Number:
67457-54-9
Molecular Formula:
C11H16O3
Molecular Weight:
196.2429
IUPAC Name:
7,8-dimethyl-2-oxaspiro[4.5]decane-1,3-dione
InChI:
InChI=1S/C11H16O3/c1-7-3-4-11(5-8(7)2)6-9(12)14-10(11)13/h7-8H,3-6H2,1-2H3
InChI Key:
GDNPLKNEZFMJGE-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)C2(C1)CCC(C(C2)C)C
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.246g/mol
Monoisotopic Mass:
196.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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