(2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid

C20H18O6 — CID 10808026

IUPAC(2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid
SMILESO=C1O[C@@H]([C@@H](OCc2ccccc2)C(=O)O)C=C1OCc1ccccc1
InChIInChI=1S/C20H18O6/c21-19(22)18(25-13-15-9-5-2-6-10-15)16-11-17(20(23)26-16)24-12-14-7-3-1-4-8-14/h1-11,16,18H,12-13H2,(H,21,22)/t16-,18-/m1/s1
InChIKeyJQLTUKBEDPOITK-SJLPKXTDSA-N
MW354.36 g/mol
LogP2.68
Rot. Bonds8

About (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid

(2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid (PubChem CID 10808026) has the molecular formula C20H18O6 and a molecular weight of 354.36 g/mol. Its IUPAC name is (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid.

Molecular Properties

Compound Name(2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid
PubChem CID10808026
Molecular FormulaC20H18O6
Molecular Weight354.36 g/mol
Exact Mass354.11
IUPAC Name(2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid
SMILESO=C1O[C@@H]([C@@H](OCc2ccccc2)C(=O)O)C=C1OCc1ccccc1
InChIInChI=1S/C20H18O6/c21-19(22)18(25-13-15-9-5-2-6-10-15)16-11-17(20(23)26-16)24-12-14-7-3-1-4-8-14/h1-11,16,18H,12-13H2,(H,21,22)/t16-,18-/m1/s1
InChIKeyJQLTUKBEDPOITK-SJLPKXTDSA-N
XLogP2.68
TPSA82.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.36
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid with MolForge

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Related Compounds

N-[(1S,2R,3S,4R)-2,3,4,5-tetrahydroxy-1-[(2S)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]pentyl]acetamide
CID 23260033
(2R,3R)-3,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one
CID 154508733
(3S,4R)-3-methyl-4-[(1S)-3-oxo-1-phenylmethoxybutyl]oxetan-2-one
CID 101455375
(2R,4S)-2,3-dimethyl-4-phenylmethoxypentanoic acid
CID 134864943
ethane;(2S)-2-[2-[(2S)-2-[2-(2-phenylmethoxypropanoyloxy)propanoyloxy]propanoyl]oxypropanoyloxy]propanoic acid
CID 143088943
2-phenylmethoxybutanoic acid
CID 11816388
(2R)-2-phenylmethoxy-3-(4-phenylmethoxyphenyl)propanoic acid
CID 122390059
2-[4-oxo-3-(1-phenylmethoxyethyl)azetidin-2-yl]propanoic acid
CID 19933355
3-phenylmethoxy-1H-azet-2-one
CID 174589199
(2R)-2-[(2R)-3-oxo-4-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]morpholin-2-yl]-2-phenylmethoxyacetic acid
CID 70308902
(2R)-2-[(1R)-1,2-dihydroxyethyl]-3-hydroxy-4-phenylmethoxy-2H-furan-5-one
CID 70356460
(2R)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methoxy-N-methyl-2-phenylmethoxyacetamide
CID 101470087

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid?
The IUPAC name of (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid (CID 10808026) is (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid.
What is the SMILES notation for (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid?
The canonical SMILES for (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid is O=C1O[C@@H]([C@@H](OCc2ccccc2)C(=O)O)C=C1OCc1ccccc1.
What is the InChIKey of (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid?
The InChIKey is JQLTUKBEDPOITK-SJLPKXTDSA-N. The full InChI is InChI=1S/C20H18O6/c21-19(22)18(25-13-15-9-5-2-6-10-15)16-11-17(20(23)26-16)24-12-14-7-3-1-4-8-14/h1-11,16,18H,12-13H2,(H,21,22)/t16-,18-/m1/s1.
What are the key properties of (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid?
(2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid has a molecular weight of 354.36 g/mol, XLogP of 2.68, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2R)-5-oxo-4-phenylmethoxy-2H-furan-2-yl]-2-phenylmethoxyacetic acid is sourced from PubChem (CID 10808026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).