Ethyl 2-Chloro-5-(2-pyridyl)-1H-pyrrole-3-carboxylate - CAS 881732-41-8
Catalog: |
BB038771 |
Product Name: |
Ethyl 2-Chloro-5-(2-pyridyl)-1H-pyrrole-3-carboxylate |
CAS: |
881732-41-8 |
Synonyms: |
2-chloro-5-(2-pyridinyl)-1H-pyrrole-3-carboxylic acid ethyl ester; ethyl 2-chloro-5-pyridin-2-yl-1H-pyrrole-3-carboxylate |
IUPAC Name: | ethyl 2-chloro-5-pyridin-2-yl-1H-pyrrole-3-carboxylate |
Description: | Ethyl 2-Chloro-5-(2-pyridyl)-1H-pyrrole-3-carboxylate (CAS# 881732-41-8 ) is a useful research chemical. |
Molecular Weight: | 250.68 |
Molecular Formula: | C12H11ClN2O2 |
Canonical SMILES: | CCOC(=O)C1=C(NC(=C1)C2=CC=CC=N2)Cl |
InChI: | InChI=1S/C12H11ClN2O2/c1-2-17-12(16)8-7-10(15-11(8)13)9-5-3-4-6-14-9/h3-7,15H,2H2,1H3 |
InChI Key: | IHTPQVHCARFBKV-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
EP-1803709-A1 | Proton pump inhibitors | 20040930 |
EP-2336107-A2 | Proton pump inhibitors | 20040930 |
US-2008139639-A1 | Proton Pump Inhibitors | 20040930 |
US-2011028476-A1 | Proton pump inhibitors | 20040930 |
US-8048909-B2 | Proton pump inhibitors | 20040930 |
Complexity: | 275 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 250.0509053 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 250.0509053 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 55 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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