Methyl 4-Fluorotetrahydropyran-4-carboxylate - CAS 1150617-60-9
Catalog: |
BB003482 |
Product Name: |
Methyl 4-Fluorotetrahydropyran-4-carboxylate |
CAS: |
1150617-60-9 |
Synonyms: |
4-fluoro-4-oxanecarboxylic acid methyl ester; methyl 4-fluorooxane-4-carboxylate |
IUPAC Name: | methyl 4-fluorooxane-4-carboxylate |
Description: | Methyl 4-Fluorotetrahydropyran-4-carboxylate (CAS# 1150617-60-9) is a useful research chemical. |
Molecular Weight: | 162.16 |
Molecular Formula: | C7H11FO3 |
Canonical SMILES: | COC(=O)C1(CCOCC1)F |
InChI: | InChI=1S/C7H11FO3/c1-10-6(9)7(8)2-4-11-5-3-7/h2-5H2,1H3 |
InChI Key: | MMRSDRAYRVDTJH-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 0.67810 |
Publication Number | Title | Priority Date |
AU-2017332839-A1 | Preparation and uses of pyrimidinone derivatives | 20160922 |
CA-3037605-A1 | Preparation and uses of pyrimidinone derivatives | 20160922 |
EP-3515903-A1 | Preparation and uses of pyrimidinone derivatives | 20160922 |
JP-2019531345-A | Preparation and use of pyrimidinone derivatives | 20160922 |
US-2020123157-A1 | Preparation and uses of pyrimidinone derivative | 20160922 |
Complexity: | 152 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.06922237 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.06922237 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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