| CAS Number | 27423-80-9 |
| Catalog Number | AG00C3I0(AGN-PC-0WOBCG) |
| Chemical Name | 2-[3-(trifluoromethyl)phenyl]-1H-imidazole |
| IUPAC Name | 2-[3-(trifluoromethyl)phenyl]-1H-imidazole |
| InChI | InChI=1S/C10H7F3N2/c11-10(12,13)8-3-1-2-7(6-8)9-14-4-5-15-9/h1-6H,(H,14,15) |
| InChI Key | FKNKITNWTIFPFX-UHFFFAOYSA-N |
| MDL Number | MFCD08668838 |
| Molecular Formula | C10H7F3N2 |
| Molecular Weight | 212.1712 |
| SMILES | FC(C1=CC(C2NC=CN=2)=CC=C1)(F)F |
| Synonyms | 2-[3-(trifluoromethyl)phenyl]-1H-imidazole,
27423-80-9,
2-(3-(Trifluoromethyl)phenyl)-1H-imidazole,
SCHEMBL1719134,
ZINC34759460,
AKOS008144054,
MCULE-7777233819,
NE13967,
NCGC00374427-01,
2-(3-trifluoromethylphenyl)-1h-imidazole,
2-(3-trifluoromethyl-phenyl)-1h-imidazole,
EN300-74995,
Z1259155930,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.175g/mol |
| Monoisotopic Mass | 212.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number