| CAS Number | 1955506-17-8 |
| Catalog Number | AG01AJ2A |
| Chemical Name | 4-(1-methyl-2,3-dihydro-1H-imidazol-2-ylidene)cyclohexa-2,5-dien-1-imine hydrochloride |
| IUPAC Name | 4-(1-methylimidazol-2-yl)aniline;hydrochloride |
| InChI | InChI=1S/C10H11N3.ClH/c1-13-7-6-12-10(13)8-2-4-9(11)5-3-8;/h2-7H,11H2,1H3;1H |
| InChI Key | UJBBOPXGNQNTPZ-UHFFFAOYSA-N |
| MDL Number | MFCD28155360 |
| Molecular Formula | C10H12ClN3 |
| Molecular Weight | 209.6754 |
| SMILES | Cl.CN1/C(=C2C=CC(=N)C=C2)/NC=C1 |
| Synonyms | 4-(1-methyl-2,3-dihydro-1H-imidazol-2-ylidene)cyclohexa-2,5-dien-1-imine hydrochloride,
1955506-17-8,
4-(1-methyl-1H-imidazol-2-yl)aniline hydrochloride,
AKOS026727795,
NE31971,
EN300-79597,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.677g/mol |
| Monoisotopic Mass | 209.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number