Methyl 2-fluoropyridine-4-carboxylate - CAS 455-69-6
Catalog: |
BB025931 |
Product Name: |
Methyl 2-fluoropyridine-4-carboxylate |
CAS: |
455-69-6 |
Synonyms: |
methyl 2-fluoropyridine-4-carboxylate |
IUPAC Name: | methyl 2-fluoropyridine-4-carboxylate |
Description: | Methyl 2-fluoropyridine-4-carboxylate (CAS# 455-69-6) is a useful research chemical. |
Molecular Weight: | 155.13 |
Molecular Formula: | C7H6FNO2 |
Canonical SMILES: | COC(=O)C1=CC(=NC=C1)F |
InChI: | InChI=1S/C7H6FNO2/c1-11-7(10)5-2-3-9-6(8)4-5/h2-4H,1H3 |
InChI Key: | MTZKFHSYUSUUIU-UHFFFAOYSA-N |
Boiling Point: | 227.7 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.251 g/cm3 |
Appearance: | Colorless to tan liquid |
MDL: | MFCD11656063 |
LogP: | 1.00730 |
GHS Hazard Statement: | H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P280, P305+P351+P338, and P310 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112891348-A | Use and pharmaceutical composition of phenyl isoxazolyl methylene-naphthalene-ether derivatives | 20191203 |
CN-112898289-A | Compounds for modulating FXR activity and uses thereof | 20191203 |
WO-2021108974-A1 | Compounds for modulating activity of fxr and uses thereof | 20191203 |
WO-2021109712-A1 | Compounds for modulating activity of fxr and uses thereof | 20191203 |
WO-2021109713-A1 | Use and pharmaceutical composition of phenylisoxazolyl methylene-naphthalene-ether derivatives | 20191203 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.03825660 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.03825660 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 39.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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