| CAS Number | 1788612-25-8 |
| Catalog Number | AG01BEEB |
| Chemical Name | 2-iodo-4-methoxyaniline hydrochloride |
| IUPAC Name | 2-iodo-4-methoxyaniline;hydrochloride |
| InChI | InChI=1S/C7H8INO.ClH/c1-10-5-2-3-7(9)6(8)4-5;/h2-4H,9H2,1H3;1H |
| InChI Key | NYYWYBWOIHAIBH-UHFFFAOYSA-N |
| MDL Number | MFCD28063989 |
| Molecular Formula | C7H9ClINO |
| Molecular Weight | 285.5099 |
| SMILES | Cl.COC1=CC(I)=C(N)C=C1 |
| Synonyms | 2-iodo-4-methoxyaniline hydrochloride,
1788612-25-8,
MCULE-8294488303,
Z1868316833,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 284.942g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 285.509g/mol |
| Monoisotopic Mass | 284.942g/mol |
| Rotatable Bond Count | 1 |
| 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