5-Bromo-1-propyl-benzoimidazole - CAS 1200113-99-0
Catalog: |
BB071586 |
Product Name: |
5-Bromo-1-propyl-benzoimidazole |
CAS: |
1200113-99-0 |
Synonyms: |
5-Bromo-1-propyl-benzoimidazole; 5-bromo-1-propylbenzimidazole; 5-Bromo-1-propyl-1H-benzimidazole |
IUPAC Name: | 5-bromo-1-propylbenzimidazole |
Description: | 5-Bromo-1-propyl-benzoimidazole |
Molecular Weight: | 239.11 |
Molecular Formula: | C10H11BrN2 |
Canonical SMILES: | CCCN1C=NC2=C1C=CC(=C2)Br |
InChI: | InChI=1S/C10H11BrN2/c1-2-5-13-7-12-9-6-8(11)3-4-10(9)13/h3-4,6-7H,2,5H2,1H3 |
InChI Key: | STSGZOPADMCOGE-UHFFFAOYSA-N |
Complexity: | 174 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.01056 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.01056 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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