(3R,5S)-5-(hydroxymethyl)oxolan-3-ol

C5H10O3 — CID 5289103

IUPAC(3R,5S)-5-(hydroxymethyl)oxolan-3-ol
SMILESOC[C@@H]1C[C@@H](O)CO1
InChIInChI=1S/C5H10O3/c6-2-5-1-4(7)3-8-5/h4-7H,1-3H2/t4-,5+/m1/s1
InChIKeyWDMXOLOBWMBITN-UHNVWZDZSA-N
MW118.13 g/mol
LogP-0.87
Rot. Bonds1

About (3R,5S)-5-(hydroxymethyl)oxolan-3-ol

(3R,5S)-5-(hydroxymethyl)oxolan-3-ol (PubChem CID 5289103) has the molecular formula C5H10O3 and a molecular weight of 118.13 g/mol. Its IUPAC name is (3R,5S)-5-(hydroxymethyl)oxolan-3-ol.

Molecular Properties

Compound Name(3R,5S)-5-(hydroxymethyl)oxolan-3-ol
PubChem CID5289103
Molecular FormulaC5H10O3
Molecular Weight118.13 g/mol
Exact Mass118.06
IUPAC Name(3R,5S)-5-(hydroxymethyl)oxolan-3-ol
SMILESOC[C@@H]1C[C@@H](O)CO1
InChIInChI=1S/C5H10O3/c6-2-5-1-4(7)3-8-5/h4-7H,1-3H2/t4-,5+/m1/s1
InChIKeyWDMXOLOBWMBITN-UHNVWZDZSA-N
XLogP-0.87
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.13
LogP ≤ 5-0.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R,5S)-5-(hydroxymethyl)oxolan-3-ol?
The IUPAC name of (3R,5S)-5-(hydroxymethyl)oxolan-3-ol (CID 5289103) is (3R,5S)-5-(hydroxymethyl)oxolan-3-ol.
What is the SMILES notation for (3R,5S)-5-(hydroxymethyl)oxolan-3-ol?
The canonical SMILES for (3R,5S)-5-(hydroxymethyl)oxolan-3-ol is OC[C@@H]1C[C@@H](O)CO1.
What is the InChIKey of (3R,5S)-5-(hydroxymethyl)oxolan-3-ol?
The InChIKey is WDMXOLOBWMBITN-UHNVWZDZSA-N. The full InChI is InChI=1S/C5H10O3/c6-2-5-1-4(7)3-8-5/h4-7H,1-3H2/t4-,5+/m1/s1.
What are the key properties of (3R,5S)-5-(hydroxymethyl)oxolan-3-ol?
(3R,5S)-5-(hydroxymethyl)oxolan-3-ol has a molecular weight of 118.13 g/mol, XLogP of -0.87, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5S)-5-(hydroxymethyl)oxolan-3-ol is sourced from PubChem (CID 5289103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).