Methyl 4,5-Dibromo-1-methylpyrrole-2-carboxylate - CAS 1198-71-6
Catalog: |
BB004676 |
Product Name: |
Methyl 4,5-Dibromo-1-methylpyrrole-2-carboxylate |
CAS: |
1198-71-6 |
Synonyms: |
4,5-dibromo-1-methyl-2-pyrrolecarboxylic acid methyl ester; methyl 4,5-dibromo-1-methylpyrrole-2-carboxylate |
IUPAC Name: | methyl 4,5-dibromo-1-methylpyrrole-2-carboxylate |
Description: | Methyl 4,5-Dibromo-1-methylpyrrole-2-carboxylate (CAS# 1198-71-6) is a useful research chemical. |
Molecular Weight: | 296.94 |
Molecular Formula: | C7H7Br2NO2 |
Canonical SMILES: | CN1C(=CC(=C1Br)Br)C(=O)OC |
InChI: | InChI=1S/C7H7Br2NO2/c1-10-5(7(11)12-2)3-4(8)6(10)9/h3H,1-2H3 |
InChI Key: | UTOZAUBXQWRZIF-UHFFFAOYSA-N |
LogP: | 2.33670 |
Publication Number | Title | Priority Date |
EP-2224809-A1 | Inhibition of biofilms in plants with imidazole derivatives | 20071127 |
US-2009143230-A1 | Inhibition of biofilms in plants with imidazole derivatives | 20071127 |
US-2012328577-A1 | Inhibition of biofilms in plants with imidazole derivatives | 20071127 |
US-2014079808-A1 | Inhibition of biofilms in plants with imidazole derivatives | 20071127 |
US-8278340-B2 | Inhibition of biofilms in plants with imidazole derivatives | 20071127 |
PMID | Publication Date | Title | Journal |
20061160 | 20100201 | From anti-fouling to biofilm inhibition: new cytotoxic secondary metabolites from two Indonesian Agelas sponges | Bioorganic & medicinal chemistry |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 296.8823 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 294.88435 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 31.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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