| CAS Number | 24169-73-1 |
| Catalog Number | AG00BCZO(AGN-PC-0WBOEI) |
| Chemical Name | 2-Imidazol-1-yl-1-phenyl-ethylamine DiHCl |
| IUPAC Name | 2-imidazol-1-yl-1-phenylethanamine;dihydrochloride |
| InChI | InChI=1S/C11H13N3.2ClH/c12-11(8-14-7-6-13-9-14)10-4-2-1-3-5-10;;/h1-7,9,11H,8,12H2;2*1H |
| InChI Key | ONLIUHLROTWPLQ-UHFFFAOYSA-N |
| MDL Number | MFCD13193808 |
| Molecular Formula | C11H15Cl2N3 |
| Molecular Weight | 260.1629 |
| SMILES | Cl.Cl.NC(CN1C=CN=C1)C1=CC=CC=C1 |
| Synonyms | 24169-73-1,
2-imidazol-1-yl-1-phenyl-ethylamine dihydrochloride,
2-IMIDAZOL-1-YL-1-PHENYL-ETHYLAMINE 2HCL,
CTK7D4732,
DTXSID70592104,
ZX-AT029501,
5071AH,
AR1139,
MFCD04117728,
AS-45037,
2-Imidazol-1-yl-1-phenyl-ethylamine DiHCl,
A-8876,
2-imidazol-1-yl-1-phenylethylamine dihydrochloride,
2-(imidazol-1-yl)-1-phenylethanamine dihydrochloride,
[2-(1H-imidazol-1-yl)-1-phenylethyl]amine dihydrochloride,
2-imidazol-1-yl-1-phenyl-ethylamine dihydrochloride, AldrichCPR,
2-(1H-Imidazol-1-yl)-1-phenylethan-1-amine--hydrogen chloride (1/2),
C11H13N3.2HCl,
|
| Complexity | 166 |
| 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 | 3 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number