| CAS Number | 1431966-12-9 |
| Catalog Number | AG00HWTS(AGN-PC-0WBD00) |
| Chemical Name | (4-(1H-Imidazol-1-yl)phenyl)methanamine dihydrochloride |
| IUPAC Name | (4-imidazol-1-ylphenyl)methanamine;dihydrochloride |
| InChI | InChI=1S/C10H11N3.2ClH/c11-7-9-1-3-10(4-2-9)13-6-5-12-8-13;;/h1-6,8H,7,11H2;2*1H |
| InChI Key | FOFRAVUBYRGMOP-UHFFFAOYSA-N |
| MDL Number | MFCD25371268 |
| Molecular Formula | C10H13Cl2N3 |
| Molecular Weight | 246.1363 |
| SMILES | Cl.Cl.NCC1=CC=C(C=C1)N1C=CN=C1 |
| Synonyms | 1431966-12-9,
(4-(1H-Imidazol-1-yl)phenyl)methanamine dihydrochloride,
(4-(1H-Imidazol-1-yl)phenyl)methanamine 2HCl,
MFCD25371268,
AKOS022178646,
MCULE-3219255975,
AS-31049,
AX8283702,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.135g/mol |
| Monoisotopic Mass | 245.049g/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
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number