Basic information
- CAS
874758-54-0- Standard SMILES
CCOC(=O)C(O)c1cc(OCOC)c(OS(=O)(=O)C(F)(F)F)c2c1OCO2- InChIKey
FKRGLWANGWXCFZ-UHFFFAOYSA-N- Molecular formula
- C14H15F3O10S
- Average molar mass
- 432.32 g/mol
- Monoisotopic mass
- 432.03380233
Names & identifiers
- Preferred name
- Ethyl 2-hydroxy-2-(6-(methoxymethoxy)-7-(((trifluoromethyl)sulfonyl)oxy)benzo[d][1,3]dioxol-4-yl)acetate
- IUPAC
- ethyl 2-hydroxy-2-[6-(methoxymethoxy)-7-(trifluoromethylsulfonyloxy)-1,3-benzodioxol-4-yl]acetate
- English name
- 1,3-Benzodioxole-4-acetic acid, α-hydroxy-6-(methoxymethoxy)-7-[[(trifluoromethyl)sulfonyl]oxy]-, ethyl ester
- Molecular formula
- C14H15F3O10S
- Molecular weight
- 432.32
Names & synonyms
874758-54-0Ethyl 2-hydroxy-2-(6-(methoxymethoxy)-7-(((trifluoromethyl)sulfonyl)oxy)benzo[d][1,3]dioxol-4-yl)acetateethyl 2-hydroxy-2-[6-(methoxymethoxy)-7-(trifluoromethylsulfonyloxy)-1,3-benzodioxol-4-yl]acetateSCHEMBL1755321C14H15F3O10SDTXSID801116323CS-M2926MFCD28385897AKOS037650458CS-14841C12806Ethyl hydroxy{6-(methoxymethoxy)-7-[(trifluoromethanesulfonyl)oxy]-2H-1,3-benzodioxol-4-yl}acetate
Show more names
1,3-Benzodioxole-4-acetic acid, α-hydroxy-6-(methoxymethoxy)-7-[[(trifluoromethyl)sulfonyl]oxy]-, ethyl ester
Ethyl I+/--hydroxy-6-(methoxymethoxy)-7-[[(trifluoromethyl)sulfonyl]oxy]-1,3-benzodioxole-4-acetateEthyl2-hydroxy-2-(6-(methoxymethoxy)-7-(((trifluoromethyl)sulfonyl)oxy)benzo[d][1,3]dioxol-4-yl)acetate
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 634
Chemistry & industry
Suppliers1 total
上海皓元医药股份有限公司021-58950125 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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