5-Chloro-2-hydroxypyridine - CAS 4214-79-3
Catalog: |
BB025061 |
Product Name: |
5-Chloro-2-hydroxypyridine |
CAS: |
4214-79-3 |
Synonyms: |
2(1H)-Pyridinone, 5-chloro-; 2(1H)-Pyridone, 5-chloro-; 2-Pyridinol, 5-chloro-; 5-Chloro-2(1H)-pyridinone; 2-Hydroxy-5-chloropyridine; 3-Chloro-6-hydroxypyridine; 5-Chloro-1,2-dihydropyridin-2-one; 5-Chloro-1H-2-pyridinone; 5-Chloro-2(1H)-pyridone; 5-Chloro-2-pyridinol; 5-Chloro-2-pyridone |
Related CAS: | 13466-36-9 (Deleted CAS) 109163-42-0 (Deleted CAS)
|
IUPAC Name: | 5-chloro-1H-pyridin-2-one |
Description: | 5-Chloro-2-hydroxypyridine (CAS# 4214-79-3) is used in preparation of Benzenesulfonamide derivatives and analogs as ATP citrate Lyase inhibitors. |
Molecular Weight: | 129.54 |
Molecular Formula: | C5H4ClNO |
Canonical SMILES: | C1=CC(=O)NC=C1Cl |
InChI: | InChI=1S/C5H4ClNO/c6-4-1-2-5(8)7-3-4/h1-3H,(H,7,8) |
InChI Key: | SZFUWUOHDRMCKD-UHFFFAOYSA-N |
Boiling Point: | 290.7±40.0°C at 760 mmHg |
Melting Point: | 163°C |
Purity: | ≥95% |
Density: | 1.35±0.1 g/cm3 |
Appearance: | White to Orange to Green Powder to Crystal |
Storage: | Store at RT |
MDL: | MFCD00006275 |
LogP: | 1.44060 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112851485-A | Preparation method of ticagrelor key intermediate | 20210115 |
CN-111351890-A | Method for detecting halogenated pyridinol disinfection byproducts in water body | 20200330 |
CN-111351890-B | Method for detecting halogenated pyridinol disinfection byproducts in water body | 20200330 |
CN-113072476-A | ROR gamma t inhibitor and preparation method and application thereof | 20200106 |
CN-113072542-A | ROR gamma t inhibitor and preparation method and application thereof | 20200106 |
PMID | Publication Date | Title | Journal |
15672163 | 20050207 | A new [2 + 2] photodimerization of 5-chloro- and 5-methyl-2-pyridone in their inclusion complexes with 1,1'-biphenyl-2,2'-dicarboxylic acid as a model for DNA damage by photodimerization of its thymine component | Chemical communications (Cambridge, England) |
11932541 | 20020401 | catena-Poly[diaquabis(5-chloropyridinium-2-olato-kappaO)copper(II)]-mu-pyrazine-kappa2N:N'] diperchlorate] | Acta crystallographica. Section C, Crystal structure communications |
Complexity: | 171 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 128.9981414 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 128.9981414 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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