| CAS Number | 1955540-65-4 |
| Catalog Number | AG01B2K1 |
| Chemical Name | 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-imidazole hydrochloride |
| IUPAC Name | 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-imidazole;hydrochloride |
| InChI | InChI=1S/C11H10N2O2.ClH/c1-2-9-10(15-6-5-14-9)7-8(1)11-12-3-4-13-11;/h1-4,7H,5-6H2,(H,12,13);1H |
| InChI Key | DLAHITUDUBDBSG-UHFFFAOYSA-N |
| MDL Number | MFCD29991643 |
| Molecular Formula | C11H11ClN2O2 |
| Molecular Weight | 238.6702 |
| SMILES | Cl.C1OC2=C(C=C(C3NC=CN=3)C=C2)OC1 |
| Synonyms | 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-imidazole hydrochloride,
1955540-65-4,
Z2492799785,
|
| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 238.671g/mol |
| Monoisotopic Mass | 238.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 47.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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