| CAS Number | 39959-87-0 |
| Catalog Number | AG019WOZ |
| Chemical Name | 1-(2-AMINOETHOXY)-2,3-DICHLOROBENZENE HYDROCHLORIDE |
| IUPAC Name | 2-(2,3-dichlorophenoxy)ethanamine;hydrochloride |
| InChI | InChI=1S/C8H9Cl2NO.ClH/c9-6-2-1-3-7(8(6)10)12-5-4-11;/h1-3H,4-5,11H2;1H |
| InChI Key | WXJRJTRCMNYTHI-UHFFFAOYSA-N |
| MDL Number | MFCD12913146 |
| Molecular Formula | C8H10Cl3NO |
| Molecular Weight | 242.5301 |
| SMILES | ClC1=C(Cl)C(OCCN)=CC=C1.[H]Cl |
| Synonyms | 1-(2-aminoethoxy)-2,3-dichlorobenzene hydrochloride,
39959-87-0,
2-(2,3-dichlorophenoxy)ethan-1-amine hydrochloride,
AC1Q3DEC,
SCHEMBL1290535,
CTK7E9162,
MCULE-2433462788,
NE57449,
EN300-52695,
Z763367894,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.983g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.524g/mol |
| Monoisotopic Mass | 240.983g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number