Methyl 2-(3-fluoro-4-(trifluoromethylsulfonyloxy)phenyl)acetate

HCID 59627703

Completing data — usually done within a minute

Basic information

CAS
1259022-71-3
Standard SMILES
COC(=O)Cc1ccc(OS(=O)(=O)C(F)(F)F)c(F)c1
InChIKey
GYMTWFOUJTXQLN-UHFFFAOYSA-N
Molecular formula
C10H8F4O5S
Average molar mass
316.23 g/mol
Monoisotopic mass
316.00285724

Names & identifiers

Preferred name
Methyl 2-(3-fluoro-4-(trifluoromethylsulfonyloxy)phenyl)acetate
IUPAC
methyl 2-[3-fluoro-4-(trifluoromethylsulfonyloxy)phenyl]acetate

Names & synonyms

methyl 2-(3-fluoro-4-(trifluoromethylsulfonyloxy)phenyl)acetate1259022-71-3methyl 2-[3-fluoro-4-(trifluoromethylsulfonyloxy)phenyl]acetateSCHEMBL2126108SCHEMBL30154424DTXSID001137979DB-297787Methyl {3-fluoro-4-[(trifluoromethanesulfonyl)oxy]phenyl}acetatemethyl 2-(3-fluoro-4-(((trifluoromethyl)sulfonyl)oxy)phenyl)acetateBenzeneacetic acid, 3-fluoro-4-[[(trifluoromethyl)sulfonyl]oxy]-, methyl ester

Database identifiers

CAS
1259022-71-3
PubChem CID
59627703
DTXSID
DTXSID001137979

Properties

Computed structural propertiesFilling in

XLogP
2.6
Topological polar surface area
78.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
5
Heavy atoms
20

Related reactions

5 records

Compound notes

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