(2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol

C5H10O4 — CID 91205052

IUPAC(2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol
SMILESOC[C@@H]1O[C@H](O)C[C@@H]1O
InChIInChI=1S/C5H10O4/c6-2-4-3(7)1-5(8)9-4/h3-8H,1-2H2/t3-,4-,5-/m0/s1
InChIKeyPDWIQYODPROSQH-YUPRTTJUSA-N
MW134.13 g/mol
LogP-1.55
Rot. Bonds1

About (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol

(2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol (PubChem CID 91205052) has the molecular formula C5H10O4 and a molecular weight of 134.13 g/mol. Its IUPAC name is (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol.

Molecular Properties

Compound Name(2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol
PubChem CID91205052
Molecular FormulaC5H10O4
Molecular Weight134.13 g/mol
Exact Mass134.06
IUPAC Name(2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol
SMILESOC[C@@H]1O[C@H](O)C[C@@H]1O
InChIInChI=1S/C5H10O4/c6-2-4-3(7)1-5(8)9-4/h3-8H,1-2H2/t3-,4-,5-/m0/s1
InChIKeyPDWIQYODPROSQH-YUPRTTJUSA-N
XLogP-1.55
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.13
LogP ≤ 5-1.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,4R,5S,6R)-6-(hydroxymethyl)oxane-2,4,5-triol
CID 7057906
(2R,6R)-6-(hydroxymethyl)oxane-2,4,5-triol
CID 148934060
(5S,6R)-6-(hydroxymethyl)oxane-2,4,5-triol
CID 70641511
(2R,3R,5R,6R)-6-(hydroxymethyl)oxane-2,3,5-triol
CID 67701993
(3S,5R)-6-(hydroxymethyl)oxane-2,3,5-triol
CID 154684690
(2R,3S,5S,6R)-6-(hydroxymethyl)oxane-2,3,5-triol
CID 27556866
(3R,6S)-6-(hydroxymethyl)oxane-2,3,5-triol
CID 155780384
6-(hydroxymethyl)-5-propan-2-yloxane-2,4-diol
CID 167208192
CID 59914550
CID 59914550
2-(hydroxymethyl)-5-sulfanyloxolan-3-ol
CID 123868889
(2R,3S,5R)-5-chloro-2-(hydroxymethyl)oxolan-3-ol
CID 67099694
(2S,3R,5R)-2-(hydroxymethyl)-5-methyloxolan-3-ol
CID 59795765

Frequently Asked Questions

What is the IUPAC name of (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol?
The IUPAC name of (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol (CID 91205052) is (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol.
What is the SMILES notation for (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol?
The canonical SMILES for (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol is OC[C@@H]1O[C@H](O)C[C@@H]1O.
What is the InChIKey of (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol?
The InChIKey is PDWIQYODPROSQH-YUPRTTJUSA-N. The full InChI is InChI=1S/C5H10O4/c6-2-4-3(7)1-5(8)9-4/h3-8H,1-2H2/t3-,4-,5-/m0/s1.
What are the key properties of (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol?
(2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol has a molecular weight of 134.13 g/mol, XLogP of -1.55, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S,5S)-5-(hydroxymethyl)oxolane-2,4-diol is sourced from PubChem (CID 91205052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).