2-Cyclopropyl-4-(4-fluorophenyl)-quinolyl-3-methanol - CAS 121660-11-5
Catalog: |
BB005233 |
Product Name: |
2-Cyclopropyl-4-(4-fluorophenyl)-quinolyl-3-methanol |
CAS: |
121660-11-5 |
Synonyms: |
2-Cyclopropyl-4-(4'-fluorophenyl)Quinolyl-3-methanol; Pitavastatin Impurity 31 |
Application: |
Pitavastatin intermediate. |
IUPAC Name: | [2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]methanol |
Description: | 2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinemethanol is one of Pitavastatin intermediates. Pitavastatin, also called as itavastatin, is a potent HMG-CoA reductase inhibitor. And studies showed that pitavastatin inhibited the activity of Rho-kinase depending on the inactivation of Rho by inhibiting the mevalonate pathway. |
Molecular Weight: | 293.33 |
Molecular Formula: | C19H16FNO |
Canonical SMILES: | C1CC1C2=NC3=CC=CC=C3C(=C2CO)C4=CC=C(C=C4)F |
InChI: | InChI=1S/C19H16FNO/c20-14-9-7-12(8-10-14)18-15-3-1-2-4-17(15)21-19(13-5-6-13)16(18)11-22/h1-4,7-10,13,22H,5-6,11H2 |
InChI Key: | FIZDBNPUFMDGFZ-UHFFFAOYSA-N |
Boiling Point: | 474.7±45.0°C at 760 mmHg |
Melting Point: | 134-136°C |
Purity: | ≥95% |
Density: | 1.286 g/cm3 (Predicted) |
Solubility: | Soluble in Chloroform (Slightly), Methanol (Slightly) |
Appearance: | White to pale yellow solid |
Storage: | Store at -20°C |
LogP: | 4.41060 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112175007-A | Preparation method of pitavastatin calcium intermediate | 20201013 |
CN-111747978-A | Silicon-center chiral tetra-substituted silane and preparation method thereof | 20200709 |
CN-109867695-A | A kind of new preparation process of Pitavastatin Calcium intermediate | 20171201 |
CN-109867695-B | Novel preparation method of pitavastatin calcium intermediate | 20171201 |
CN-109422681-A | A kind of preparation method of Pitavastatin Calcium intermediate | 20170829 |
PMID | Publication Date | Title | Journal |
21589152 | 20101031 | [2-Cyclo-propyl-4-(4-fluoro-phenyl)quinolin-3-yl]methanol | Acta crystallographica. Section E, Structure reports online |
Complexity: | 378 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 293.121592296 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 293.121592296 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 33.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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