| CAS Number | 40067-22-9 |
| Catalog Number | AG01ACJT(AGN-PC-00OOFH) |
| Chemical Name | 3,5-Dichloro-4-ethoxyaniline |
| IUPAC Name | 3,5-dichloro-4-ethoxyaniline |
| InChI | InChI=1S/C8H9Cl2NO/c1-2-12-8-6(9)3-5(11)4-7(8)10/h3-4H,2,11H2,1H3 |
| InChI Key | JCYWFHRQFXSCCN-UHFFFAOYSA-N |
| MDL Number | MFCD11647690 |
| Molecular Formula | C8H9Cl2NO |
| Molecular Weight | 206.0692 |
| SMILES | CCOC1=C(Cl)C=C(N)C=C1Cl |
| Synonyms | 3,5-Dichloro-4-ethoxyaniline,
40067-22-9,
Benzenamine, 3,5-dichloro-4-ethoxy-,
SCHEMBL1457714,
JCYWFHRQFXSCCN-UHFFFAOYSA-N,
3,5-Dichloro-4-ethoxy-phenylamine,
ZINC34515000,
NE42223,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.066g/mol |
| Monoisotopic Mass | 205.006g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number