1-(4-Iodophenyl)ethyl methyl carbonate
Basic information
- CAS
32313-89-6- Standard SMILES
COC(=O)OC(C)c1ccc(I)cc1- InChIKey
WIKGKVGWIDFCJN-UHFFFAOYSA-N- Molecular formula
- C10H11IO3
- Average molar mass
- 306.1 g/mol
- Monoisotopic mass
- 305.97529
Names & identifiers
- Preferred name
- 1-(4-Iodophenyl)ethyl methyl carbonate
- IUPAC
- 1-(4-iodophenyl)ethyl methyl carbonate
Names & synonyms
1-(4-Iodophenyl)ethyl methyl carbonate32313-89-6DTXSID80954113RefChem:1054412DTXCID701382147BRN 1960425Carbonic acid, 1-(4-iodophenyl)ethyl methyl esterSCHEMBL11574007
Database identifiers
- CAS
32313-89-6- PubChem CID
- 208508
- DTXSID
DTXSID80954113
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 188
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Compound notes
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