Phenyl phenylacetate - CAS 722-01-0
Catalog: |
BB034569 |
Product Name: |
Phenyl phenylacetate |
CAS: |
722-01-0 |
Synonyms: |
phenyl 2-phenylacetate |
IUPAC Name: | phenyl 2-phenylacetate |
Description: | Phenyl phenylacetate (CAS# 722-01-0 ) is a useful research chemical. |
Molecular Weight: | 212.24 |
Molecular Formula: | C14H12O2 |
Canonical SMILES: | C1=CC=C(C=C1)CC(=O)OC2=CC=CC=C2 |
InChI: | InChI=1S/C14H12O2/c15-14(11-12-7-3-1-4-8-12)16-13-9-5-2-6-10-13/h1-10H,11H2 |
InChI Key: | USVNNHYNCCJCCP-UHFFFAOYSA-N |
Boiling Point: | 158 °C / 7 mmHg (lit.) |
Density: | 1.13 g/cm3 |
MDL: | MFCD00216650 |
LogP: | 2.83470 |
Publication Number | Title | Priority Date |
WO-2021005484-A1 | Pyrrolidine compounds, its salt and use in the preparation of upadacitinib thereof | 20190711 |
WO-2021005436-A1 | Combination therapy of gpr119 agonists and dpp-4 inhibitors | 20190708 |
WO-2020234898-A1 | Process for manufacturing soft chewable free flowing granules and companion animal products thereof | 20190521 |
WO-2020194115-A1 | Process for the preparation of elagolix sodium and intermediates thereof | 20190325 |
WO-2020160939-A1 | Bismuth-containing catalyst comprising at least one aromatic substituent | 20190207 |
PMID | Publication Date | Title | Journal |
16038580 | 20060101 | Comparisons of photo-fries rearrangements of 4-dodecylphenyl phenylacetate and two structurally related esters in hexane and polyethylene cages. How important are anchoring chains? | Photochemistry and photobiology |
15332820 | 20040906 | Structural and functional models of the active site of zinc phosphotriesterase | Inorganic chemistry |
Complexity: | 213 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.083729621 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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