1a-Phenyl-1,1a,6,6a-tetrahydrocyclopropa[a]indene
Basic information
- CAS
82645-20-3- Standard SMILES
c1ccc(C23CC2Cc2ccccc23)cc1- InChIKey
HESRJXOWZPVQJX-UHFFFAOYSA-N- Molecular formula
- C16H14
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.10955045
Names & identifiers
- Preferred name
- 1a-Phenyl-1,1a,6,6a-tetrahydrocyclopropa[a]indene
- IUPAC
- 1a-phenyl-6,6a-dihydro-1H-cyclopropa[a]indene
Names & synonyms
1a-Phenyl-1,1a,6,6a-tetrahydrocyclopropa[a]indene82645-20-3DTXSID60513444
Database identifiers
- CAS
82645-20-3- PubChem CID
- 12937752
- DTXSID
DTXSID60513444- Nikkaji
- J1.976.277G
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 276
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Compound notes
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