| CAS Number | 1092305-02-6 |
| Catalog Number | AG019S2H |
| Chemical Name | N1-methyl-3-(trifluoromethyl)benzene-1,4-diamine |
| IUPAC Name | 4-N-methyl-2-(trifluoromethyl)benzene-1,4-diamine |
| InChI | InChI=1S/C8H9F3N2/c1-13-5-2-3-7(12)6(4-5)8(9,10)11/h2-4,13H,12H2,1H3 |
| InChI Key | CELZLLGYMCAGSW-UHFFFAOYSA-N |
| MDL Number | MFCD10690843 |
| Molecular Formula | C8H9F3N2 |
| Molecular Weight | 190.1657 |
| SMILES | CNC1=CC(C(F)(F)F)=C(N)C=C1 |
| Synonyms | 1-N-methyl-3-(trifluoromethyl)benzene-1,4-diamine,
1092305-02-6,
ZINC26516385,
NE25781,
EN300-91534,
N1-methyl-3-(trifluoromethyl)benzene-1,4-diamine,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.169g/mol |
| Monoisotopic Mass | 190.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number