(5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one

C8H14O4 — CID 23238602

IUPAC(5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one
SMILESCO[C@@H](CO)C[C@H]1CCC(=O)O1
InChIInChI=1S/C8H14O4/c1-11-7(5-9)4-6-2-3-8(10)12-6/h6-7,9H,2-5H2,1H3/t6-,7-/m1/s1
InChIKeyVJGBFCWKZCHCEW-RNFRBKRXSA-N
MW174.20 g/mol
LogP0.09
Rot. Bonds4

About (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one

(5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one (PubChem CID 23238602) has the molecular formula C8H14O4 and a molecular weight of 174.20 g/mol. Its IUPAC name is (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one.

Molecular Properties

Compound Name(5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one
PubChem CID23238602
Molecular FormulaC8H14O4
Molecular Weight174.20 g/mol
Exact Mass174.09
IUPAC Name(5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one
SMILESCO[C@@H](CO)C[C@H]1CCC(=O)O1
InChIInChI=1S/C8H14O4/c1-11-7(5-9)4-6-2-3-8(10)12-6/h6-7,9H,2-5H2,1H3/t6-,7-/m1/s1
InChIKeyVJGBFCWKZCHCEW-RNFRBKRXSA-N
XLogP0.09
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one?
The IUPAC name of (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one (CID 23238602) is (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one.
What is the SMILES notation for (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one?
The canonical SMILES for (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one is CO[C@@H](CO)C[C@H]1CCC(=O)O1.
What is the InChIKey of (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one?
The InChIKey is VJGBFCWKZCHCEW-RNFRBKRXSA-N. The full InChI is InChI=1S/C8H14O4/c1-11-7(5-9)4-6-2-3-8(10)12-6/h6-7,9H,2-5H2,1H3/t6-,7-/m1/s1.
What are the key properties of (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one?
(5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one has a molecular weight of 174.20 g/mol, XLogP of 0.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[(2R)-3-hydroxy-2-methoxypropyl]oxolan-2-one is sourced from PubChem (CID 23238602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).