Methyl 2-Fluoro-3-methoxybenzoate - CAS 958991-48-5
Catalog: |
BB041872 |
Product Name: |
Methyl 2-Fluoro-3-methoxybenzoate |
CAS: |
958991-48-5 |
Synonyms: |
2-fluoro-3-methoxybenzoic acid methyl ester; methyl 2-fluoro-3-methoxybenzoate |
IUPAC Name: | methyl 2-fluoro-3-methoxybenzoate |
Description: | Methyl 2-Fluoro-3-methoxybenzoate (CAS# 958991-48-5) is a useful research chemical. |
Molecular Weight: | 184.16 |
Molecular Formula: | C9H9FO3 |
Canonical SMILES: | COC1=CC=CC(=C1F)C(=O)OC |
InChI: | InChI=1S/C9H9FO3/c1-12-7-5-3-4-6(8(7)10)9(11)13-2/h3-5H,1-2H3 |
InChI Key: | GRWBDUGTSMVZOH-UHFFFAOYSA-N |
Storage: | Sealed in dry, Room Temperature |
LogP: | 1.62090 |
Publication Number | Title | Priority Date |
CN-109311847-A | Pyrazole derivatives as inhibitors of plasma kallikrein | 20160531 |
EP-2197876-A1 | Thiazole and oxazole kinase inhibitors | 20070829 |
JP-2010538003-A | Thiazole and oxazole kinase inhibitors | 20070829 |
US-2011190280-A1 | Thiazole And Oxazole Kinase Inhibitors | 20070829 |
WO-2009032667-A1 | Thiazole and oxazole kinase inhibitors | 20070829 |
Complexity: | 184 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.05357231 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.05357231 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 35.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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