| CAS Number | 267874-51-1 |
| Catalog Number | AG00BHRM |
| Chemical Name | (1H-Benzo[d]imidazol-6-yl)methanamine dihydrochloride |
| IUPAC Name | 3H-benzimidazol-5-ylmethanamine;dihydrochloride |
| InChI | InChI=1S/C8H9N3.2ClH/c9-4-6-1-2-7-8(3-6)11-5-10-7;;/h1-3,5H,4,9H2,(H,10,11);2*1H |
| InChI Key | QGCVTNMXYDMSSZ-UHFFFAOYSA-N |
| MDL Number | MFCD28978699 |
| Molecular Formula | C8H11Cl2N3 |
| Molecular Weight | 220.0990 |
| SMILES | NCC1=CC=C2C(NC=N2)=C1.[H]Cl.[H]Cl |
| Synonyms | (1H-Benzimidazol-5-ylmethyl)amine dihydrochloride,
267874-51-1,
779353-78-5,
(1H-benzo[d]imidazol-6-yl)methanamine dihydrochloride,
SCHEMBL7220537,
MFCD26959748,
AKOS030242782,
FS-6116,
1H-1,3-benzodiazol-5-ylmethanamine dihydrochloride,
(1H-1,3-benzodiazol-5-yl)methanamine dihydrochloride,
(1H-1,3-benzodiazol-6-yl)methanamine dihydrochloride,
Z2235810192,
C-(3H-Benzoimidazol-5-yl)-methylamine dihydrochloride,
|
| Complexity | 137 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.097g/mol |
| Monoisotopic Mass | 219.033g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number