Basic information
- Standard SMILES
O=C(OCCOCCI)c1ccccc1- InChIKey
RVWAFDRQMFCETI-UHFFFAOYSA-N- Molecular formula
- C11H13IO3
- Average molar mass
- 320.12 g/mol
- Monoisotopic mass
- 319.99094
Names & identifiers
- Preferred name
- 2-(2-Iodoethoxy)ethyl benzoate
- IUPAC
- 2-(2-iodoethoxy)ethyl benzoate
Names & synonyms
2-(2-iodoethoxy)ethyl benzoate871026-03-8SCHEMBL2747308RVWAFDRQMFCETI-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 21361868
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 179
Related reactions
6 records
Compound notes
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