Methyl 3-(2,4-Difluorophenyl)-3-oxopropionate - CAS 185302-85-6
Catalog: |
BB014217 |
Product Name: |
Methyl 3-(2,4-Difluorophenyl)-3-oxopropionate |
CAS: |
185302-85-6 |
Synonyms: |
3-(2,4-difluorophenyl)-3-oxopropanoic acid methyl ester; methyl 3-(2,4-difluorophenyl)-3-oxopropanoate |
IUPAC Name: | methyl 3-(2,4-difluorophenyl)-3-oxopropanoate |
Description: | Methyl 3-(2,4-Difluorophenyl)-3-oxopropionate (CAS# 185302-85-6 ) is a useful research chemical. |
Molecular Weight: | 214.17 |
Molecular Formula: | C10H8F2O3 |
Canonical SMILES: | COC(=O)CC(=O)C1=C(C=C(C=C1)F)F |
InChI: | InChI=1S/C10H8F2O3/c1-15-10(14)5-9(13)7-3-2-6(11)4-8(7)12/h2-4H,5H2,1H3 |
InChI Key: | SHYGKBSEUWXPBM-UHFFFAOYSA-N |
MDL: | MFCD03424792 |
LogP: | 1.71060 |
Publication Number | Title | Priority Date |
JP-3603141-B2 | Method for producing β-ketocarboxylic acid ester | 19950418 |
JP-H08291109-A | Process for producing β-ketocarboxylic acid ester | 19950418 |
Complexity: | 255 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 214.04415044 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 214.04415044 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 43.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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