[(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate

C18H15FO5 — CID 7439958

IUPAC[(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate
SMILESO=C(O[C@@H]1CCOC1=O)c1ccccc1OCc1ccc(F)cc1
InChIInChI=1S/C18H15FO5/c19-13-7-5-12(6-8-13)11-23-15-4-2-1-3-14(15)17(20)24-16-9-10-22-18(16)21/h1-8,16H,9-11H2/t16-/m1/s1
InChIKeyCVLNKTFOPAHMCX-MRXNPFEDSA-N
MW330.31 g/mol
LogP2.88
Rot. Bonds5

About [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate

[(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate (PubChem CID 7439958) has the molecular formula C18H15FO5 and a molecular weight of 330.31 g/mol. Its IUPAC name is [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate.

Molecular Properties

Compound Name[(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate
PubChem CID7439958
Molecular FormulaC18H15FO5
Molecular Weight330.31 g/mol
Exact Mass330.09
IUPAC Name[(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate
SMILESO=C(O[C@@H]1CCOC1=O)c1ccccc1OCc1ccc(F)cc1
InChIInChI=1S/C18H15FO5/c19-13-7-5-12(6-8-13)11-23-15-4-2-1-3-14(15)17(20)24-16-9-10-22-18(16)21/h1-8,16H,9-11H2/t16-/m1/s1
InChIKeyCVLNKTFOPAHMCX-MRXNPFEDSA-N
XLogP2.88
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.31
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate with MolForge

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Related Compounds

[(3S)-2-oxooxolan-3-yl] 3-methoxy-4-phenylmethoxybenzoate
CID 2411721
(2-oxooxolan-3-yl) 5-(4-fluorophenyl)furan-2-carboxylate
CID 42918528
[(3S)-2-oxooxolan-3-yl] 2-[2-oxo-2-[3-(trifluoromethyl)anilino]ethoxy]benzoate
CID 2513576
(2-oxooxolan-3-yl) 4-(4-fluorophenoxy)benzoate
CID 42896194
[(3S)-2-oxooxolan-3-yl] 2,3-dimethylbenzoate
CID 7815401
[(3S)-2-oxooxolan-3-yl] 4-methoxynaphthalene-1-carboxylate
CID 8595816
(2-oxooxolan-3-yl) 2-(4-methylbenzoyl)benzoate
CID 23961947
(2-oxooxolan-3-yl) 2,3,4-trimethoxybenzoate
CID 23847503
methyl 2-[[4-[(2-methoxycarbonylphenoxy)methyl]phenyl]methoxy]benzoate
CID 14323673
[(2S,3S)-3-(4-fluorophenyl)oxiran-2-yl]-(2-phenylmethoxyphenyl)methanone
CID 26985531
(4-aminopiperidin-1-yl)-[2-[(4-fluorophenyl)methoxy]phenyl]methanone;hydrochloride
CID 119373858
[2-(2-bromophenyl)-2-oxoethyl] 2-[(4-fluorophenyl)methoxy]benzoate
CID 23768164

Frequently Asked Questions

What is the IUPAC name of [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate?
The IUPAC name of [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate (CID 7439958) is [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate.
What is the SMILES notation for [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate?
The canonical SMILES for [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate is O=C(O[C@@H]1CCOC1=O)c1ccccc1OCc1ccc(F)cc1.
What is the InChIKey of [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate?
The InChIKey is CVLNKTFOPAHMCX-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H15FO5/c19-13-7-5-12(6-8-13)11-23-15-4-2-1-3-14(15)17(20)24-16-9-10-22-18(16)21/h1-8,16H,9-11H2/t16-/m1/s1.
What are the key properties of [(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate?
[(3R)-2-oxooxolan-3-yl] 2-[(4-fluorophenyl)methoxy]benzoate has a molecular weight of 330.31 g/mol, XLogP of 2.88, 5 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-[(4-fluorophenyl)methoxy]benzoate is sourced from PubChem (CID 7439958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).