7,9-di-ter-butyl-1-oxospiro-(4,5)-deca-6,9-diene-2,8-dione

7,9-di-ter-butyl-1-oxospiro-(4,5)-deca-6,9-diene-2,8-dione
Compound Structure:
Synonyms: 82304-66-3;7,9-Di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione;7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione;7,9-Di-tert-butyl-1-oxaspiro(4,5)deca-6,9-diene-2,8-dione;7,9-Di-tert-butyl-1-oxaspiro[4,5]deca-6,9-diene-2,8-dione
Compound ID: NMPC-488
PubChem ID:

545303
Molecular Formula: C17H24O3
Canonical SMILES: CC(C)(C)C1=CC2(CCC(=O)O2)C=C(C1=O)C(C)(C)C
InChIKey: ZTMZUYHXZPUDRF-UHFFFAOYSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

222.37 g/mol

XLogP3-AA

3.7

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

1

Rotatable Bond Count

1

Exact Mass

222.198365449 g/mol

Monoisotopic Mass

222.198365449 g/mol

Topological Polar Surface Area

20.2Ų

Heavy Atom Count

16

Formal Charge

0

Complexity

292

Isotope Atom Count

0

Defined Atom Stereocenter Count

3

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

                                                     
Source Species: Cyathula prostrata
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