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methyl 3-(trifluoromethyl)benzoate; sulfurochloridic acid

methyl 3-(trifluoromethyl)benzoate; sulfurochloridic acid

Systemtic Name:methyl 3-(trifluoromethyl)benzoate; sulfurochloridic acid
Openeye Name:methyl 3-(trifluoromethyl)benzoate; sulfurochloridic acid
CAS Name:sulfurochloridic acid; 3-(trifluoromethyl)benzoic acid methyl ester
IUPAC Name:methyl 3-(trifluoromethyl)benzoate; sulfurochloridic acid
Traditional Name:sulfurochloridic acid; 3-(trifluoromethyl)benzoic acid methyl ester
Formula: C9H8ClF3O5S
MolecularWeight: 320.67003
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)C(F)(F)F.OS(=O)(=O)Cl


Isomeric SMILES

COC(=O)C1=CC(=CC=C1)C(F)(F)F.OS(=O)(=O)Cl


InChI

InChI=1S/C9H7F3O2.ClHO3S/c1-14-8(13)6-3-2-4-7(5-6)9(10,11)12;1-5(2,3)4/h2-5H,1H3;(H,2,3,4)


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