| CAS Number | 61033-86-1 |
| Catalog Number | AG01FS68(AGN-PC-0SYLHU) |
| Chemical Name | 4-(4,5-Dihydro-1H-imidazol-2-yl)aniline hydrochloride |
| IUPAC Name | 4-(4,5-dihydro-1H-imidazol-2-yl)aniline;hydrochloride |
| InChI | InChI=1S/C9H11N3.ClH/c10-8-3-1-7(2-4-8)9-11-5-6-12-9;/h1-4H,5-6,10H2,(H,11,12);1H |
| InChI Key | SHDZIGFWOKNAKD-UHFFFAOYSA-N |
| MDL Number | MFCD00463827 |
| Molecular Formula | C9H12ClN3 |
| Molecular Weight | 197.6647 |
| NSC Number | 56414 |
| SMILES | NC1=CC=C(C2=NCCN2)C=C1.[H]Cl |
| Synonyms | 4-(4,5-Dihydro-1H-imidazol-2-yl)aniline hydrochloride,
61033-86-1,
6621-98-3,
DTXSID40660662,
NSC56414,
NSC-56414,
AK689152,
DS-20221,
4-(4,5-Dihydro-1H-imidazol-2-yl)aniline--hydrogen chloride (1/1),
|
| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.071975g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.66g/mol |
| Monoisotopic Mass | 197.071975g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.4Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number