| CAS Number | 1017778-56-1 |
| Catalog Number | AG00VRP1(AGN-PC-0WAOMB) |
| Chemical Name | 3,6-Dichloro-2-fluoroaniline |
| IUPAC Name | 3,6-dichloro-2-fluoroaniline |
| InChI | InChI=1S/C6H4Cl2FN/c7-3-1-2-4(8)6(10)5(3)9/h1-2H,10H2 |
| InChI Key | QNMHNBIMWNQSAL-UHFFFAOYSA-N |
| MDL Number | MFCD09832331 |
| Molecular Formula | C6H4Cl2FN |
| Molecular Weight | 180.0071 |
| SMILES | C1(N)C(Cl)=CC=C(Cl)C=1F |
| Synonyms | 3,6-DICHLORO-2-FLUOROANILINE,
1017778-56-1,
CTK6G8845,
3,6-dichloro-2-fluorophenylamine,
3,6-Dichloro-2-fluoroaniline, JRD,
SBB089597,
ZINC38529967,
AKOS006283189,
FCH2606987,
AS-43957,
PC302824,
MFCD09832331,
348-64-1,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.003g/mol |
| Monoisotopic Mass | 178.97g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number