5-(2-Pyridyl)-1H-pyrrole-3-carbaldehyde - CAS 881674-54-0
Catalog: |
BB038764 |
Product Name: |
5-(2-Pyridyl)-1H-pyrrole-3-carbaldehyde |
CAS: |
881674-54-0 |
Synonyms: |
5-(2-pyridinyl)-1H-pyrrole-3-carboxaldehyde; 5-pyridin-2-yl-1H-pyrrole-3-carbaldehyde |
IUPAC Name: | 5-pyridin-2-yl-1H-pyrrole-3-carbaldehyde |
Description: | 5-(2-Pyridyl)-1H-pyrrole-3-carbaldehyde (CAS# 881674-54-0 ) is a useful research chemical. |
Molecular Weight: | 172.18 |
Molecular Formula: | C10H8N2O |
Canonical SMILES: | C1=CC=NC(=C1)C2=CC(=CN2)C=O |
InChI: | InChI=1S/C10H8N2O/c13-7-8-5-10(12-6-8)9-3-1-2-4-11-9/h1-7,12H |
InChI Key: | MAEDNWRCZDCTDT-UHFFFAOYSA-N |
LogP: | 1.88920 |
Publication Number | Title | Priority Date |
CA-2582777-A1 | Proton pump inhibitors | 20040930 |
EP-1803709-A1 | Proton pump inhibitors | 20040930 |
EP-1803709-B1 | Proton pump inhibitors | 20040930 |
EP-2336107-A2 | Proton pump inhibitors | 20040930 |
EP-2336107-B1 | Proton pump inhibitors | 20040930 |
Complexity: | 184 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.063662883 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 45.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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