Methyl (R)-3-(4-Fluorophenyl)-2-hydroxypropionate - CAS 124980-98-9
Catalog: |
BB006037 |
Product Name: |
Methyl (R)-3-(4-Fluorophenyl)-2-hydroxypropionate |
CAS: |
124980-98-9 |
Synonyms: |
(2R)-3-(4-fluorophenyl)-2-hydroxypropanoic acid methyl ester; methyl (2R)-3-(4-fluorophenyl)-2-hydroxypropanoate |
IUPAC Name: | methyl (2R)-3-(4-fluorophenyl)-2-hydroxypropanoate |
Description: | Reactant used in the preparation of antipicornaviral agents, rhinovirus protease inhibitors and agents for treatment of chemokine mediated diseases. |
Molecular Weight: | 198.19 |
Molecular Formula: | C10H11FO3 |
Canonical SMILES: | COC(=O)C(CC1=CC=C(C=C1)F)O |
InChI: | InChI=1S/C10H11FO3/c1-14-10(13)9(12)6-7-2-4-8(11)5-3-7/h2-5,9,12H,6H2,1H3/t9-/m1/s1 |
InChI Key: | OKWFDTMQPLAWLR-SECBINFHSA-N |
Boiling Point: | 291.708 ℃ at 760 mmHg |
Density: | 1.232 g/cm3 |
LogP: | 0.90210 |
Publication Number | Title | Priority Date |
BR-112019009977-A2 | anthelmintic depsipeptide compounds | 20161116 |
AU-2006270548-A1 | Novel piperidine derivatives | 20050721 |
BR-PI0613563-A2 | new piperidine derivatives | 20050721 |
CA-2615650-A1 | Novel piperidine derivatives | 20050721 |
EP-1912941-A1 | Novel piperidine derivatives | 20050721 |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.06922237 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.06922237 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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