(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one

C20H20O6 — CID 22885541

IUPAC(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one
SMILESO=C1O[C@H]([C@@H](O)CO)C(OCc2ccccc2)=C1OCc1ccccc1
InChIInChI=1S/C20H20O6/c21-11-16(22)17-18(24-12-14-7-3-1-4-8-14)19(20(23)26-17)25-13-15-9-5-2-6-10-15/h1-10,16-17,21-22H,11-13H2/t16-,17+/m0/s1
InChIKeyGEIBUUPSUZXTHF-DLBZAZTESA-N
MW356.37 g/mol
LogP1.91
Rot. Bonds8

About (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one

(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one (PubChem CID 22885541) has the molecular formula C20H20O6 and a molecular weight of 356.37 g/mol. Its IUPAC name is (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one.

Molecular Properties

Compound Name(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one
PubChem CID22885541
Molecular FormulaC20H20O6
Molecular Weight356.37 g/mol
Exact Mass356.13
IUPAC Name(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one
SMILESO=C1O[C@H]([C@@H](O)CO)C(OCc2ccccc2)=C1OCc1ccccc1
InChIInChI=1S/C20H20O6/c21-11-16(22)17-18(24-12-14-7-3-1-4-8-14)19(20(23)26-17)25-13-15-9-5-2-6-10-15/h1-10,16-17,21-22H,11-13H2/t16-,17+/m0/s1
InChIKeyGEIBUUPSUZXTHF-DLBZAZTESA-N
XLogP1.91
TPSA85.22 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.37
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one?
The IUPAC name of (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one (CID 22885541) is (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one.
What is the SMILES notation for (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one?
The canonical SMILES for (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one is O=C1O[C@H]([C@@H](O)CO)C(OCc2ccccc2)=C1OCc1ccccc1.
What is the InChIKey of (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one?
The InChIKey is GEIBUUPSUZXTHF-DLBZAZTESA-N. The full InChI is InChI=1S/C20H20O6/c21-11-16(22)17-18(24-12-14-7-3-1-4-8-14)19(20(23)26-17)25-13-15-9-5-2-6-10-15/h1-10,16-17,21-22H,11-13H2/t16-,17+/m0/s1.
What are the key properties of (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one?
(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one has a molecular weight of 356.37 g/mol, XLogP of 1.91, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-bis(phenylmethoxy)-2H-furan-5-one is sourced from PubChem (CID 22885541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).