Basic information
- Standard SMILES
COC(=O)c1ccc(OS(=O)(=O)C(F)(F)F)cc1C(=O)OC- InChIKey
CMMMLNPIZUXFMW-UHFFFAOYSA-N- Molecular formula
- C11H9F3O7S
- Average molar mass
- 342.25 g/mol
Names & identifiers
- Preferred name
- 1,2-Dimethyl 4-(trifluoromethanesulfonyloxy)benzene-1,2-dicarboxylate
- IUPAC
- dimethyl 4-(trifluoromethylsulfonyloxy)benzene-1,2-dicarboxylate
Names & synonyms
147810-06-81,2-dimethyl 4-(trifluoromethanesulfonyloxy)benzene-1,2-dicarboxylateDimethyl 4-trifluoromethanesulphonyloxyphthalateSCHEMBL5569165DB-407121EN300-373808301,2-Dimethyl 4-[[(trifluoromethyl)sulfonyl]oxy]-1,2-benzenedicarboxylate
Database identifiers
- PubChem CID
- 19089344
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 523
Related reactions
2 records
Compound notes
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