CAS
56341-39-0 Purity
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56341-39-0 Purity
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Specification
The molecular formula is C11H8F3NO2.
The molecular weight is 243.18 g/mol.
The IUPAC name is methyl 5-(trifluoromethyl)-1H-indole-2-carboxylate.
The InChI is InChI=1S/C11H8F3NO2/c1-17-10(16)9-5-6-4-7(11(12,13)14)2-3-8(6)15-9/h2-5,15H,1H3.
The InChIKey is FXGFFFIBKZLKIY-UHFFFAOYSA-N.
The canonical SMILES is COC(=O)C1=CC2=C(N1)C=CC(=C2)C(F)(F)F.
The CAS number is 1362860-89-6.
The EC number is 815-918-4.
The XLogP3 value is 3.3.
Yes, it is a canonicalized compound.