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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
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M191944-50mg
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50mg |
3
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$26.90
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M191944-250mg
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250mg |
3
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$110.90
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M191944-1g
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1g |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
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$270.90
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| Synonyms | D78067 | Albendazole impurity G [EP] | Carbamic acid, N-(6-chloro-1H-benzimidazol-2-yl)-, methyl ester | Fenbendazole impurity B | A879671 | MFCD08234600 | Methyl (6-chloro-1H-benzimidazol-2-yl)carbamate | methyl N-(6-chloro-1H-1,3-benzodiazol-2-yl)carbam |
|---|---|
| Specifications & Purity | ≥98% |
| Storage Temp | Store at -20°C |
| Shipped In |
Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available. |
| Product Description |
Application: Methyl [5(6)-chlorobenzimidazole-2-yl]carbamate is an impurity for Fenbendazole (F246750), an anthelmintic (Nematodes). (Albendazole Impurity H) |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Benzimidazoles |
| Subclass | 2-benzimidazolylcarbamic acid esters |
| Intermediate Tree Nodes | Not available |
| Direct Parent | 2-benzimidazolylcarbamic acid esters |
| Alternative Parents | Benzenoids Aryl chlorides Imidazoles Heteroaromatic compounds Carbamate esters Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 2-benzimidazolylcarbamic acid ester - Aryl chloride - Aryl halide - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Carbamic acid ester - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as 2-benzimidazolylcarbamic acid esters. These are aromatic heteropolycyclic compounds that contain a carbamic acid ester group, which is N-linked to the C2-atom of a benzimidazole moiety. |
| External Descriptors | Not available |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
|---|
| Pubchem Sid | 504765364 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504765364 |
| IUPAC Name | methyl N-(6-chloro-1H-benzimidazol-2-yl)carbamate |
| INCHI | InChI=1S/C9H8ClN3O2/c1-15-9(14)13-8-11-6-3-2-5(10)4-7(6)12-8/h2-4H,1H3,(H2,11,12,13,14) |
| InChIKey | VLEJNRYXCWJNPA-UHFFFAOYSA-N |
| Smiles | COC(=O)NC1=NC2=C(N1)C=C(C=C2)Cl |
| Isomeric SMILES | COC(=O)NC1=NC2=C(N1)C=C(C=C2)Cl |
| Molecular Weight | 225.63 |
| Reaxy-Rn | 917084 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=917084&ln= |
| Solubility | DMSO (Slightly) |
|---|---|
| Molecular Weight | 225.630 g/mol |
| XLogP3 | 2.100 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 225.031 Da |
| Monoisotopic Mass | 225.031 Da |
| Topological Polar Surface Area | 67.000 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 252.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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