Basic information
- CAS
163394-75-0- Standard SMILES
CC(C)(C)C1CC=C(c2cccc(I)c2)CC1- InChIKey
GADZVROXHHPSJF-UHFFFAOYSA-N- Molecular formula
- C16H21I
- Average molar mass
- 340.24 g/mol
- Monoisotopic mass
- 340.0688
Names & identifiers
- Preferred name
- Benzene, 1-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]-3-iodo-
- IUPAC
- 1-(4-tert-butylcyclohexen-1-yl)-3-iodobenzene
Names & synonyms
163394-75-0Benzene, 1-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]-3-iodo-DTXSID504790654-tert-Butyl-3'-iodo-2,3,4,5-tetrahydro-1,1'-biphenyl
Database identifiers
- CAS
163394-75-0- PubChem CID
- 12168221
- DTXSID
DTXSID50479065- Nikkaji
- J665.450I
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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