5-Bromo-1-ethylbenzoimidazole hydrochloride - CAS 1365271-54-0
Catalog: |
BB072032 |
Product Name: |
5-Bromo-1-ethylbenzoimidazole hydrochloride |
CAS: |
1365271-54-0 |
Synonyms: |
5-Bromo-1-ethylbenzoimidazole HCl; 5-bromo-1-ethylbenzimidazole; hydrochloride; 5-Bromo-1-ethylbenzoimidazole hydrochloride |
IUPAC Name: | 5-bromo-1-ethylbenzimidazolehydrochloride |
Description: | 5-Bromo-1-ethylbenzoimidazole HCl |
Molecular Weight: | 225.085+(36.46) |
Molecular Formula: | C9H9BrN2·HCl |
Canonical SMILES: | CCN1C=NC2=C1C=CC(=C2)Br.Cl |
InChI: | InChI=1S/C9H9BrN2.ClH/c1-2-12-6-11-8-5-7(10)3-4-9(8)12/h3-6H,2H2,1H31H |
InChI Key: | TUYZTKRBGXSCCF-UHFFFAOYSA-N |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 259.97159 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 259.97159 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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