| CAS Number | 1152960-41-2 |
| Catalog Number | AG01AXIJ(AGN-PC-0WNLSD) |
| Chemical Name | 4-chloro-N-ethyl-2-fluoroaniline |
| IUPAC Name | 4-chloro-N-ethyl-2-fluoroaniline |
| InChI | InChI=1S/C8H9ClFN/c1-2-11-8-4-3-6(9)5-7(8)10/h3-5,11H,2H2,1H3 |
| InChI Key | RTUWFYKOYPWJJN-UHFFFAOYSA-N |
| MDL Number | MFCD12146989 |
| Molecular Formula | C8H9ClFN |
| Molecular Weight | 173.6152 |
| SMILES | CCNC1=C(F)C=C(Cl)C=C1 |
| Synonyms | 4-chloro-N-ethyl-2-fluoroaniline,
1152960-41-2,
SCHEMBL5843493,
(4-Chloro-2-fluorophenyl)ethylamine,
ZINC35022676,
AKOS004912231,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.615g/mol |
| Monoisotopic Mass | 173.041g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number