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Home > Other Heterocycles > 65817-29-0
65817-29-0 | Spiro[5.5]undeca-2,7-diene-1,9-dione, 2-methyl-5-(1-methylethyl)-
CAS No: 65817-29-0 Catalog No: AG006OFM MDL No:
Product Description
Catalog Number:
AG006OFM
Chemical Name:
Spiro[5.5]undeca-2,7-diene-1,9-dione, 2-methyl-5-(1-methylethyl)-
CAS Number:
65817-29-0
Molecular Formula:
C15H20O2
Molecular Weight:
232.3181
IUPAC Name:
4-methyl-1-propan-2-ylspiro[5.5]undeca-3,10-diene-5,9-dione
InChI:
InChI=1S/C15H20O2/c1-10(2)13-5-4-11(3)14(17)15(13)8-6-12(16)7-9-15/h4,6,8,10,13H,5,7,9H2,1-3H3
InChI Key:
VXNVGWMONRDKJN-UHFFFAOYSA-N
SMILES:
O=C1CCC2(C=C1)C(CC=C(C2=O)C)C(C)C
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.146g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.323g/mol
Monoisotopic Mass:
232.146g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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