| CAS Number | 857600-99-8 |
| Catalog Number | AG01A1RS |
| Chemical Name | 2-Methoxy-4-phenoxyaniline hydrochloride |
| IUPAC Name | 2-methoxy-4-phenoxyaniline;hydrochloride |
| InChI | InChI=1S/C13H13NO2.ClH/c1-15-13-9-11(7-8-12(13)14)16-10-5-3-2-4-6-10;/h2-9H,14H2,1H3;1H |
| InChI Key | KUCJAQSMMZSCPA-UHFFFAOYSA-N |
| MDL Number | MFCD22565920 |
| Molecular Formula | C13H14ClNO2 |
| Molecular Weight | 251.7088 |
| SMILES | Cl.COC1=C(N)C=CC(OC2=CC=CC=C2)=C1 |
| Synonyms | 2-methoxy-4-phenoxyaniline hydrochloride,
857600-99-8,
AKOS016915678,
MCULE-9996946992,
NE31290,
Z1483991614,
|
| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.71g/mol |
| Monoisotopic Mass | 251.071g/mol |
| Rotatable Bond Count | 3 |
| 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