(4R)-4-(hydroxymethyl)oxolan-2-one

C5H8O3 — CID 11815330

IUPAC(4R)-4-(hydroxymethyl)oxolan-2-one
SMILESO=C1C[C@H](CO)CO1
InChIInChI=1S/C5H8O3/c6-2-4-1-5(7)8-3-4/h4,6H,1-3H2/t4-/m1/s1
InChIKeyPVQRPRXBBGDUMX-SCSAIBSYSA-N
MW116.12 g/mol
LogP-0.46
Rot. Bonds1

About (4R)-4-(hydroxymethyl)oxolan-2-one

(4R)-4-(hydroxymethyl)oxolan-2-one (PubChem CID 11815330) has the molecular formula C5H8O3 and a molecular weight of 116.12 g/mol. Its IUPAC name is (4R)-4-(hydroxymethyl)oxolan-2-one.

Molecular Properties

Compound Name(4R)-4-(hydroxymethyl)oxolan-2-one
PubChem CID11815330
Molecular FormulaC5H8O3
Molecular Weight116.12 g/mol
Exact Mass116.05
IUPAC Name(4R)-4-(hydroxymethyl)oxolan-2-one
SMILESO=C1C[C@H](CO)CO1
InChIInChI=1S/C5H8O3/c6-2-4-1-5(7)8-3-4/h4,6H,1-3H2/t4-/m1/s1
InChIKeyPVQRPRXBBGDUMX-SCSAIBSYSA-N
XLogP-0.46
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.12
LogP ≤ 5-0.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-(hydroxymethyl)oxolan-2-one?
The IUPAC name of (4R)-4-(hydroxymethyl)oxolan-2-one (CID 11815330) is (4R)-4-(hydroxymethyl)oxolan-2-one.
What is the SMILES notation for (4R)-4-(hydroxymethyl)oxolan-2-one?
The canonical SMILES for (4R)-4-(hydroxymethyl)oxolan-2-one is O=C1C[C@H](CO)CO1.
What is the InChIKey of (4R)-4-(hydroxymethyl)oxolan-2-one?
The InChIKey is PVQRPRXBBGDUMX-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H8O3/c6-2-4-1-5(7)8-3-4/h4,6H,1-3H2/t4-/m1/s1.
What are the key properties of (4R)-4-(hydroxymethyl)oxolan-2-one?
(4R)-4-(hydroxymethyl)oxolan-2-one has a molecular weight of 116.12 g/mol, XLogP of -0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(hydroxymethyl)oxolan-2-one is sourced from PubChem (CID 11815330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).