| CAS Number | 1185299-68-6 |
| Catalog Number | AG01A9XE(AGN-PC-0WBZW4) |
| Chemical Name | 3-[(2-methyl-1H-imidazol-1-yl)methyl]aniline dihydrochloride |
| IUPAC Name | 3-[(2-methylimidazol-1-yl)methyl]aniline;dihydrochloride |
| InChI | InChI=1S/C11H13N3.2ClH/c1-9-13-5-6-14(9)8-10-3-2-4-11(12)7-10;;/h2-7H,8,12H2,1H3;2*1H |
| InChI Key | KHNRCMBPCPHFJG-UHFFFAOYSA-N |
| MDL Number | MFCD11506512 |
| Molecular Formula | C11H15Cl2N3 |
| Molecular Weight | 260.1629 |
| SMILES | Cl.Cl.CC1N(CC2=CC(N)=CC=C2)C=CN=1 |
| Synonyms | 1185299-68-6,
3-[(2-methyl-1H-imidazol-1-yl)methyl]aniline dihydrochloride,
3-(2-Methyl-imidazol-1-ylmethyl)-phenylaminedihydrochloride,
3-(2-methyl-imidazol-1-ylmethyl)-phenylamine dihydrochloride,
3-((2-Methyl-1H-imidazol-1-yl)methyl)aniline dihydrochloride,
AC1Q3A8H,
CTK7D8983,
0371AD,
AKOS008101142,
MCULE-8677559894,
NE57611,
TR-055989,
EN300-66450,
3-[(2-methylimidazol-1-yl)methyl]aniline dihydrochloride,
Z1263529588,
3-(2-Methyl-imidazol-1-ylmethyl)-phenylamine di hydrochloride,
C11H15Cl2N3,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.162g/mol |
| Monoisotopic Mass | 259.064g/mol |
| Rotatable Bond Count | 2 |
| 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