(2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol

C6H12O5 — CID 10953859

IUPAC(2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol
SMILESOC[C@@H](O)[C@H]1OC[C@H](O)[C@H]1O
InChIInChI=1S/C6H12O5/c7-1-3(8)6-5(10)4(9)2-11-6/h3-10H,1-2H2/t3-,4+,5-,6-/m1/s1
InChIKeyJNYAEWCLZODPBN-JGWLITMVSA-N
MW164.16 g/mol
LogP-2.54
Rot. Bonds2

About (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol

(2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol (PubChem CID 10953859) has the molecular formula C6H12O5 and a molecular weight of 164.16 g/mol. Its IUPAC name is (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol.

Molecular Properties

Compound Name(2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol
PubChem CID10953859
Molecular FormulaC6H12O5
Molecular Weight164.16 g/mol
Exact Mass164.07
IUPAC Name(2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol
SMILESOC[C@@H](O)[C@H]1OC[C@H](O)[C@H]1O
InChIInChI=1S/C6H12O5/c7-1-3(8)6-5(10)4(9)2-11-6/h3-10H,1-2H2/t3-,4+,5-,6-/m1/s1
InChIKeyJNYAEWCLZODPBN-JGWLITMVSA-N
XLogP-2.54
TPSA90.15 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 5-2.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol?
The IUPAC name of (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol (CID 10953859) is (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol.
What is the SMILES notation for (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol?
The canonical SMILES for (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol is OC[C@@H](O)[C@H]1OC[C@H](O)[C@H]1O.
What is the InChIKey of (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol?
The InChIKey is JNYAEWCLZODPBN-JGWLITMVSA-N. The full InChI is InChI=1S/C6H12O5/c7-1-3(8)6-5(10)4(9)2-11-6/h3-10H,1-2H2/t3-,4+,5-,6-/m1/s1.
What are the key properties of (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol?
(2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol has a molecular weight of 164.16 g/mol, XLogP of -2.54, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol is sourced from PubChem (CID 10953859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).