5-Chloro-2-methyl-4-nitropyridine 1-Oxide - CAS 97944-39-3
Catalog: |
BB042079 |
Product Name: |
5-Chloro-2-methyl-4-nitropyridine 1-Oxide |
CAS: |
97944-39-3 |
Synonyms: |
5-chloro-2-methyl-4-nitro-1-oxidopyridin-1-ium; 5-chloro-2-methyl-4-nitro-1-oxidopyridin-1-ium |
IUPAC Name: | 5-chloro-2-methyl-4-nitro-1-oxidopyridin-1-ium |
Description: | 5-Chloro-2-methyl-4-nitropyridine 1-Oxide (CAS# 97944-39-3 ) is a useful research chemical. |
Molecular Weight: | 188.57 |
Molecular Formula: | C6H5ClN2O3 |
Canonical SMILES: | CC1=[N+](C=C(C(=C1)[N+](=O)[O-])Cl)[O-] |
InChI: | InChI=1S/C6H5ClN2O3/c1-4-2-6(9(11)12)5(7)3-8(4)10/h2-3H,1H3 |
InChI Key: | WMNCRPKSHGXZFI-UHFFFAOYSA-N |
LogP: | 2.50830 |
Publication Number | Title | Priority Date |
DE-3827276-A1 | SUBSTITUTED THIENOIMIDAZOLE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME AND THEIR USE AS AN INGESTIC ACID INHIBITOR | 19870815 |
EP-0304732-A2 | Substituted thienoimidazole derivatives, process for their preparation, pharmaceutical compositions containing them and their use as gastric secretion inhibitors | 19870815 |
FI-89602-B | Foerfarande Foer framstaellning av therapeutiskt anvaendbara substituerade tienoimidazolderivat | 19870815 |
FI-89602-C | FOERFARANDE FOER FRAMSTAELLNING AV TERAPEUTISKT ANVAENDBARA SUBSTITUERADE TIENOIMIDAZOLDERIVAT | 19870815 |
HU-208539-B | Process for producing gastric acid secretion inhibition substituted thieni/3,4-d/-imidazol derivatives and pharmaceutical compositions containing them | 19870815 |
Complexity: | 184 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.9988697 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.9988697 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 71.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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