4',5',6',7'-Tetrahydrospiro[cyclohexane-1,1'-inden]-3'(2'h)-one
Basic information
- CAS
10503-80-7- Standard SMILES
O=C1CC2(CCCCC2)C2=C1CCCC2- InChIKey
CXAZLUPBTPWMBI-UHFFFAOYSA-N- Molecular formula
- C14H20O
- Average molar mass
- 204.31 g/mol
- Monoisotopic mass
- 204.15141526
Names & identifiers
- Preferred name
- 4',5',6',7'-Tetrahydrospiro[cyclohexane-1,1'-inden]-3'(2'h)-one
- IUPAC
- spiro[4,5,6,7-tetrahydro-2H-indene-3,1'-cyclohexane]-1-one
Names & synonyms
10503-80-74',5',6',7'-tetrahydrospiro[cyclohexane-1,1'-inden]-3'(2'h)-oneNSC36618SCHEMBL25026106DTXSID40284302NSC-36618
Database identifiers
- CAS
10503-80-7- PubChem CID
- 235359
- DTXSID
DTXSID40284302
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 318
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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