| CAS Number | 1200113-99-0 |
| Catalog Number | AG000Q2J(AGN-PC-0WAB2V) |
| Chemical Name | 5-Bromo-1-propyl-benzoimidazole |
| IUPAC Name | 5-bromo-1-propylbenzimidazole |
| 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 |
| MDL Number | MFCD21609570 |
| Molecular Formula | C10H11BrN2 |
| Molecular Weight | 239.1117 |
| SMILES | CCCn1cnc2c1ccc(c2)Br |
| Synonyms | 5-Bromo-1-propyl-benzoimidazole,
1200113-99-0,
5-Bromo-1-propyl-1H-benzimidazole,
ACMC-209a60,
CTK8A9415,
DTXSID80682040,
ANW-17446,
MFCD21609570,
ZINC40456650,
1H-Benzimidazole, 5-bromo-1-propyl-,
AJ-103277,
TC-106191,
Z8185,
C10H11BrN2,
5-bromo-1-propylbenzimidazole,
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| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.116g/mol |
| Monoisotopic Mass | 238.011g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number