| CAS Number | 1052533-42-2 |
| Catalog Number | AG008U1V(AGN-PC-00UCIM) |
| Chemical Name | 5-chloro-2-(4-ethoxyphenoxy)aniline hydrochloride |
| IUPAC Name | 5-chloro-2-(4-ethoxyphenoxy)aniline;hydrochloride |
| InChI | InChI=1S/C14H14ClNO2.ClH/c1-2-17-11-4-6-12(7-5-11)18-14-8-3-10(15)9-13(14)16;/h3-9H,2,16H2,1H3;1H |
| InChI Key | HXCLIYFJEYDTHC-UHFFFAOYSA-N |
| MDL Number | MFCD07287161 |
| Molecular Formula | C14H15Cl2NO2 |
| Molecular Weight | 300.1804 |
| SMILES | NC1=CC(Cl)=CC=C1OC2=CC=C(OCC)C=C2.[H]Cl |
| Synonyms | 5-chloro-2-(4-ethoxyphenoxy)aniline hydrochloride,
1052533-42-2,
MLS001004605,
CHEMBL1382048,
CTK6G2229,
AKOS027427052,
MCULE-2001011722,
NE25636,
SMR000348144,
EN300-09136,
SR-01000050578,
J-001366,
J-517275,
SR-01000050578-1,
Z56969639,
AC1Q39ZD,
|
| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 299.047984g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 300.2g/mol |
| Monoisotopic Mass | 299.047984g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 44.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number