Basic information
- Standard SMILES
CCOC(=O)C1(CCCCI)CCC1- InChIKey
DJYFEYADPMSARK-UHFFFAOYSA-N- Molecular formula
- C11H19IO2
- Average molar mass
- 310.17 g/mol
- Monoisotopic mass
- 310.04298
Names & identifiers
- Preferred name
- Ethyl 1-(4-iodobutyl)-1-cyclobutanecarboxylate
- IUPAC
- ethyl 1-(4-iodobutyl)cyclobutane-1-carboxylate
Names & synonyms
Ethyl 1-(4-iodobutyl)-1-cyclobutanecarboxylate738607-07-3SCHEMBL187550DJYFEYADPMSARK-UHFFFAOYSA-NDB-091416
Database identifiers
- PubChem CID
- 21932017
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 188
Related reactions
19 records
Compound notes
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