| CAS Number | 1909337-13-8 |
| Catalog Number | AG01C5KB |
| Chemical Name | 3-Chloro-4,5-dimethoxyaniline hydrochloride |
| IUPAC Name | 3-chloro-4,5-dimethoxyaniline;hydrochloride |
| InChI | InChI=1S/C8H10ClNO2.ClH/c1-11-7-4-5(10)3-6(9)8(7)12-2;/h3-4H,10H2,1-2H3;1H |
| InChI Key | MTZWXRYPMUEDRB-UHFFFAOYSA-N |
| MDL Number | MFCD29763439 |
| Molecular Formula | C8H11Cl2NO2 |
| Molecular Weight | 224.0844 |
| SMILES | NC1=CC(OC)=C(OC)C(Cl)=C1.[H]Cl |
| Synonyms | 3-chloro-4,5-dimethoxyaniline hydrochloride,
1909337-13-8,
AKOS033919738,
Z2465619838,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.081g/mol |
| Monoisotopic Mass | 223.017g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number