Basic information
- CAS
126628-75-9- Standard SMILES
COC(=O)C(I)=CC1CCCCC1- InChIKey
QNJBTKSILCMUNP-UHFFFAOYSA-N- Molecular formula
- C10H15IO2
- Average molar mass
- 294.13 g/mol
- Monoisotopic mass
- 294.01167772
Names & identifiers
- Preferred name
- Methyl 3-cyclohexyl-2-iodoprop-2-enoate
- IUPAC
- methyl 3-cyclohexyl-2-iodoprop-2-enoate
Names & synonyms
126628-75-9methyl 3-cyclohexyl-2-iodoprop-2-enoateSCHEMBL2645541DTXSID60709961
Database identifiers
- CAS
126628-75-9- PubChem CID
- 54237138
- DTXSID
DTXSID60709961
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 205
Related reactions
6 records
Compound notes
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