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

C10H18O4 — CID 57325873

IUPAC[(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol
SMILESOC[C@H]1CC[C@@H]([C@@H]2CC[C@H](CO)O2)O1
InChIInChI=1S/C10H18O4/c11-5-7-1-3-9(13-7)10-4-2-8(6-12)14-10/h7-12H,1-6H2/t7-,8-,9+,10+/m1/s1
InChIKeyLBBCYPJJERZPOB-IMSYWVGJSA-N
MW202.25 g/mol
LogP0.07
Rot. Bonds3

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

[(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol (PubChem CID 57325873) has the molecular formula C10H18O4 and a molecular weight of 202.25 g/mol. Its IUPAC name is [(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol.

Molecular Properties

Compound Name[(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol
PubChem CID57325873
Molecular FormulaC10H18O4
Molecular Weight202.25 g/mol
Exact Mass202.12
IUPAC Name[(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol
SMILESOC[C@H]1CC[C@@H]([C@@H]2CC[C@H](CO)O2)O1
InChIInChI=1S/C10H18O4/c11-5-7-1-3-9(13-7)10-4-2-8(6-12)14-10/h7-12H,1-6H2/t7-,8-,9+,10+/m1/s1
InChIKeyLBBCYPJJERZPOB-IMSYWVGJSA-N
XLogP0.07
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(oxiran-2-yl)oxolan-2-yl]methanol
CID 123518659
[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol
CID 12886254
ethane-1,2-diamine;[5-(hydroxymethyl)oxolan-2-yl]methanol
CID 174792194
[5-(nitrosomethyl)oxolan-2-yl]methanol
CID 129146326
[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl] dihydrogen phosphate
CID 69118795
[5-[5-[5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl]oxolan-2-yl]oxolan-2-yl]methanol
CID 132528973
6-(hydroxymethyl)oxane-2,3-diol
CID 22415851
CID 169187680
CID 169187680
[(2R)-5-(dimethylamino)oxolan-2-yl]methanol
CID 59319470
hexane-1,2,5,6-tetrol;[(2R,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol;[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]methanol
CID 159317615
[(2R,5R)-5-tert-butyloxolan-2-yl]methanol
CID 14506377
[(2S,5R)-5-prop-2-enyloxolan-2-yl]methanol
CID 25138505

Frequently Asked Questions

What is the IUPAC name of [(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol?
The IUPAC name of [(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol (CID 57325873) is [(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol.
What is the SMILES notation for [(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol?
The canonical SMILES for [(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol is OC[C@H]1CC[C@@H]([C@@H]2CC[C@H](CO)O2)O1.
What is the InChIKey of [(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol?
The InChIKey is LBBCYPJJERZPOB-IMSYWVGJSA-N. The full InChI is InChI=1S/C10H18O4/c11-5-7-1-3-9(13-7)10-4-2-8(6-12)14-10/h7-12H,1-6H2/t7-,8-,9+,10+/m1/s1.
What are the key properties of [(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol?
[(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol has a molecular weight of 202.25 g/mol, XLogP of 0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methanol is sourced from PubChem (CID 57325873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).