3-Methoxy-2-(trifluoromethyl)benzaldehyde - CAS 1214384-89-0
Catalog: |
BB060047 |
Product Name: |
3-Methoxy-2-(trifluoromethyl)benzaldehyde |
CAS: |
1214384-89-0 |
Synonyms: |
3-Methoxy-2-(trifluoromethyl)benzaldehyde; 3-Methoxy-2-(trifluoromethyl)benzaldehyd |
IUPAC Name: | 3-methoxy-2-(trifluoromethyl)benzaldehyde |
Description: | 3-Methoxy-2-(trifluoromethyl)benzaldehyde is a useful reactant for the synthesis of N- methyl pyrazoles which is being studied to treat viral infections. |
Molecular Weight: | 204.15 |
Molecular Formula: | C9H7F3O2 |
Canonical SMILES: | COC1=CC=CC(=C1C(F)(F)F)C=O |
InChI: | InChI=1S/C9H7F3O2/c1-14-7-4-2-3-6(5-13)8(7)9(10,11)12/h2-5H,1H3 |
InChI Key: | HSPNVFXNJYKWSK-UHFFFAOYSA-N |
Complexity: | 203 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 204.03981395 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.03981395 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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