Lansoprazole Chloromethyl Impurity - CAS 127337-60-4
Catalog: |
BB006787 |
Product Name: |
Lansoprazole Chloromethyl Impurity |
CAS: |
127337-60-4 |
Synonyms: |
Pyridine, 2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)-, hydrochloride (1:1) |
IUPAC Name: | 2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine;hydrochloride |
Description: | Lansoprazole Chloromethyl Impurity is an intermediate for Lansoprazole, which is used as a gastric proton pump inhibitor. |
Molecular Weight: | 276.08 |
Molecular Formula: | C9H10Cl2F3NO |
Canonical SMILES: | CC1=C(C=CN=C1CCl)OCC(F)(F)F.Cl |
InChI: | InChI=1S/C9H9ClF3NO.ClH/c1-6-7(4-10)14-3-2-8(6)15-5-9(11,12)13;/h2-3H,4-5H2,1H3;1H |
InChI Key: | CMZBQUWICURDCD-UHFFFAOYSA-N |
Boiling Point: | 295.4 °C at 760 mmHg |
Melting Point: | 208-214 °C |
Purity: | 95 % |
Appearance: | White Solid |
Storage: | Inert atmosphere, Store in freezer, under -20 °C |
MDL: | MFCD00800224 |
LogP: | 3.87190 |
GHS Hazard Statement: | H317 (94.17%): May cause an allergic skin reaction [Warning Sensitization, Skin] |
Precautionary Statement: | P261, P272, P280, P302+P352, P305+P351+P338, P310, P321, P333+P313, P363, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113354621-A | Pyridine group-containing 1-substituted benzyl-3-aryl urea compound and preparation method and application thereof | 20210604 |
CN-112707889-A | Synthesis method of lansoprazole | 20200615 |
CN-109265442-A | Method for refining raw material lansoprazole | 20181012 |
CN-110873767-A | Rapid detection method for dexlansoprazole synthetic intermediate and related substances thereof | 20180904 |
CN-108947967-B | Preparation method of lansoprazole | 20180824 |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 275.0091538 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 275.0091538 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 22.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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