[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol

C6H12O3 — CID 12886254

IUPAC[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol
SMILESOC[C@@H]1CC[C@H](CO)O1
InChIInChI=1S/C6H12O3/c7-3-5-1-2-6(4-8)9-5/h5-8H,1-4H2/t5-,6+
InChIKeyYCZZQSFWHFBKMU-OLQVQODUSA-N
MW132.16 g/mol
LogP-0.48
Rot. Bonds2

About [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol

[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol (PubChem CID 12886254) has the molecular formula C6H12O3 and a molecular weight of 132.16 g/mol. Its IUPAC name is [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol.

Molecular Properties

Compound Name[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol
PubChem CID12886254
Molecular FormulaC6H12O3
Molecular Weight132.16 g/mol
Exact Mass132.08
IUPAC Name[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol
SMILESOC[C@@H]1CC[C@H](CO)O1
InChIInChI=1S/C6H12O3/c7-3-5-1-2-6(4-8)9-5/h5-8H,1-4H2/t5-,6+
InChIKeyYCZZQSFWHFBKMU-OLQVQODUSA-N
XLogP-0.48
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol?
The IUPAC name of [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol (CID 12886254) is [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol.
What is the SMILES notation for [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol?
The canonical SMILES for [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol is OC[C@@H]1CC[C@H](CO)O1.
What is the InChIKey of [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol?
The InChIKey is YCZZQSFWHFBKMU-OLQVQODUSA-N. The full InChI is InChI=1S/C6H12O3/c7-3-5-1-2-6(4-8)9-5/h5-8H,1-4H2/t5-,6+.
What are the key properties of [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol?
[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol has a molecular weight of 132.16 g/mol, XLogP of -0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol is sourced from PubChem (CID 12886254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).