Basic information
- CAS
69507-81-9- Standard SMILES
CC1(C)CC(C)(C)C2(OC3=C([Se]2)C(C)(C)CC(C)(C)C3=O)C(=O)C1=O- InChIKey
QPIARMSQQYUZDN-UHFFFAOYSA-N- Molecular formula
- C20H28O4Se
- Average molar mass
- 411.4 g/mol
- Monoisotopic mass
- 412.11528
Names & identifiers
- Preferred name
- 4,4,4',4',6,6,6',6'-octamethylspiro[5H-1,3-benzoxaselenole-2,3'-cyclohexane]-1',2',7-trione
- IUPAC
- 4,4,4',4',6,6,6',6'-octamethylspiro[5H-1,3-benzoxaselenole-2,3'-cyclohexane]-1',2',7-trione
Names & synonyms
69507-81-9NSC3284914,4,4',4',6,6,6',6'-octamethylspiro[5H-1,3-benzoxaselenole-2,3'-cyclohexane]-1',2',7-trioneDTXSID70318306AKOS024434227NSC-328491OCTAMETHYL-TETRAHYDROSPIRO(1,3-BENZOXASELENOLE-2,1'-CYCLOHEXANE)-2',3',7-TRIONE4,4,4',4',6,6,6',6'-Octamethyl-5,6-dihydrospiro[[1,3]benzoxaselenole-2,1'-cyclohexane]-2',3',7(4H)-trione
Database identifiers
- CAS
69507-81-9- PubChem CID
- 332287
- DTXSID
DTXSID70318306
Properties
Computed structural properties
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 739
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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