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Home > Other Heterocycles > 82304-66-3
82304-66-3 | 7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
CAS No: 82304-66-3 Catalog No: AG00363U MDL No:
Product Description
Catalog Number:
AG00363U
Chemical Name:
7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
CAS Number:
82304-66-3
Molecular Formula:
C17H24O3
Molecular Weight:
276.3707
IUPAC Name:
7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
InChI:
InChI=1S/C17H24O3/c1-15(2,3)11-9-17(8-7-13(18)20-17)10-12(14(11)19)16(4,5)6/h9-10H,7-8H2,1-6H3
InChI Key:
ZTMZUYHXZPUDRF-UHFFFAOYSA-N
SMILES:
O=C1CCC2(O1)C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.173g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.376g/mol
Monoisotopic Mass:
276.173g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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