| CAS Number | 931622-34-3 |
| Catalog Number | AG00IHHS(AGN-PC-0WBOES) |
| Chemical Name | 2-(4-(Trifluoromethyl)phenoxy)propanamide |
| IUPAC Name | 2-[4-(trifluoromethyl)phenoxy]propanamide |
| InChI | InChI=1S/C10H10F3NO2/c1-6(9(14)15)16-8-4-2-7(3-5-8)10(11,12)13/h2-6H,1H3,(H2,14,15) |
| InChI Key | HVQZMYUVZYEJOH-UHFFFAOYSA-N |
| MDL Number | MFCD07661964 |
| Molecular Formula | C10H10F3NO2 |
| Molecular Weight | 233.1871 |
| SMILES | CC(OC1=CC=C(C=C1)C(F)(F)F)C(N)=O |
| Synonyms | 2-(4-(TRIFLUOROMETHYL)PHENOXY)PROPANAMIDE,
931622-34-3,
2-[4-(trifluoromethyl)phenoxy]propanamide,
SCHEMBL1116906,
CTK6A3002,
DTXSID40589627,
4796AH,
AR2183,
MFCD07661964,
AKOS008903493,
MCULE-9957825299,
AS-45290,
DB-013804,
FT-0710598,
Propanamide, 2-[4-(trifluoromethyl)phenoxy]-,
Z17856095,
C10H10F3NO2,
|
| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.19g/mol |
| Monoisotopic Mass | 233.066g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number