| CAS Number | 84250-74-8 |
| Catalog Number | AG019FZ5(AGN-PC-07HCAN) |
| Chemical Name | 4-Iodo-N-methylaniline hydrochloride |
| IUPAC Name | 4-iodo-N-methylaniline;hydrochloride |
| InChI | InChI=1S/C7H8IN.ClH/c1-9-7-4-2-6(8)3-5-7;/h2-5,9H,1H3;1H |
| InChI Key | AELHUBGUILEBOZ-UHFFFAOYSA-N |
| MDL Number | MFCD12912932 |
| Molecular Formula | C7H9ClIN |
| Molecular Weight | 269.5105 |
| SMILES | CNC1=CC=C(I)C=C1.[H]Cl |
| Synonyms | 4-iodo-N-methylaniline hydrochloride,
84250-74-8,
AC1Q3BQ2,
CTK6I4842,
AKOS022182763,
MCULE-8937935589,
NE57566,
EN300-51172,
Z744582716,
4-iodo-N-methyl-aniline hydrochloride,
|
| Complexity | 77 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 268.947g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.51g/mol |
| Monoisotopic Mass | 268.947g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H315-H319
|
|
Packing Group
|
|
|
Precautionary statements
|
P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
|
|
UN Code
|
|
Certificate of Analysis
Lot Number