5-Methylnicotinoyl Chloride Hydrochloride - CAS 896740-06-0
Catalog: |
BB039564 |
Product Name: |
5-Methylnicotinoyl Chloride Hydrochloride |
CAS: |
896740-06-0 |
Synonyms: |
5-methyl-3-pyridinecarbonyl chloride;hydrochloride; 5-methylpyridine-3-carbonyl chloride;hydrochloride |
IUPAC Name: | 5-methylpyridine-3-carbonyl chloride;hydrochloride |
Description: | 5-Methylnicotinoyl Chloride Hydrochloride (CAS# 896740-06-0 ) is a useful research chemical. |
Molecular Weight: | 192.04 |
Molecular Formula: | C7H7Cl2NO |
Canonical SMILES: | CC1=CN=CC(=C1)C(=O)Cl.Cl |
InChI: | InChI=1S/C7H6ClNO.ClH/c1-5-2-6(7(8)10)4-9-3-5;/h2-4H,1H3;1H |
InChI Key: | FSDOJIBZLKUUSU-UHFFFAOYSA-N |
LogP: | 2.57100 |
Publication Number | Title | Priority Date |
CA-2594325-A1 | Condensed imidazole compound and use thereof | 20041228 |
EP-1832588-A1 | Condensed imidazole compound and use thereof | 20041228 |
JP-WO2006070943-A1 | Condensed imidazole compounds and uses thereof | 20041228 |
US-2008167314-A1 | Condensed Imidazole Compound And Use Thereof | 20041228 |
WO-2006070943-A1 | Condensed imidazole compound and use thereof | 20041228 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 190.9904692 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 190.9904692 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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