Methyl 3,3,3-trifluoro-2-iodopropanoate
Basic information
- CAS
666-93-3- Standard SMILES
COC(=O)C(I)C(F)(F)F- InChIKey
IORDRIVETCCBSG-UHFFFAOYSA-N- Molecular formula
- C4H4F3IO2
- Average molar mass
- 267.97 g/mol
- Monoisotopic mass
- 267.92081
Names & identifiers
- Preferred name
- Methyl 3,3,3-trifluoro-2-iodopropanoate
- IUPAC
- methyl 3,3,3-trifluoro-2-iodopropanoate
- English name
- Methyl 3,3,3-trifluoro-2-iodopropionate
- Molecular formula
- C4H4F3IO2
- Molecular weight
- 267.97
Names & synonyms
666-93-3methyl 3,3,3-trifluoro-2-iodopropanoateDTXSID80663091RefChem:354488DTXCID90613840Methyl 2-iodo-3,3,3-trifluoropropanoateMETHYL 3,3,3-TRIFLUORO-2-IODOPROPIONATE866-93-3Methyl 2-iodo-3,3,3-trifluoropropionateMethyl 2-iodo-3,3,3-trifluoropropanoate 97+%3,3,3-Trifluoro-2-iodopropanoicacidmethylesterPropanoic acid, 3,3,3-trifluoro-2-iodo-, methyl ester
Database identifiers
- CAS
666-93-3- PubChem CID
- 45075688
- DTXSID
DTXSID80663091
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 133
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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