[(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate

C20H20O5 — CID 7683863

IUPAC[(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate
SMILESCCOC(C(=O)O[C@@H]1CCOC1=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20O5/c1-2-24-20(15-9-5-3-6-10-15,16-11-7-4-8-12-16)19(22)25-17-13-14-23-18(17)21/h3-12,17H,2,13-14H2,1H3/t17-/m1/s1
InChIKeyOLBBZTULRKWEFD-QGZVFWFLSA-N
MW340.38 g/mol
LogP2.83
Rot. Bonds6

About [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate

[(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate (PubChem CID 7683863) has the molecular formula C20H20O5 and a molecular weight of 340.38 g/mol. Its IUPAC name is [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate.

Molecular Properties

Compound Name[(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate
PubChem CID7683863
Molecular FormulaC20H20O5
Molecular Weight340.38 g/mol
Exact Mass340.13
IUPAC Name[(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate
SMILESCCOC(C(=O)O[C@@H]1CCOC1=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20O5/c1-2-24-20(15-9-5-3-6-10-15,16-11-7-4-8-12-16)19(22)25-17-13-14-23-18(17)21/h3-12,17H,2,13-14H2,1H3/t17-/m1/s1
InChIKeyOLBBZTULRKWEFD-QGZVFWFLSA-N
XLogP2.83
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate?
The IUPAC name of [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate (CID 7683863) is [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate.
What is the SMILES notation for [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate?
The canonical SMILES for [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate is CCOC(C(=O)O[C@@H]1CCOC1=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate?
The InChIKey is OLBBZTULRKWEFD-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H20O5/c1-2-24-20(15-9-5-3-6-10-15,16-11-7-4-8-12-16)19(22)25-17-13-14-23-18(17)21/h3-12,17H,2,13-14H2,1H3/t17-/m1/s1.
What are the key properties of [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate?
[(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate has a molecular weight of 340.38 g/mol, XLogP of 2.83, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-2-oxooxolan-3-yl] 2-ethoxy-2,2-diphenylacetate is sourced from PubChem (CID 7683863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).