(5S)-5-(methoxymethyl)oxolan-2-one

C6H10O3 — CID 14768494

IUPAC(5S)-5-(methoxymethyl)oxolan-2-one
SMILESCOC[C@@H]1CCC(=O)O1
InChIInChI=1S/C6H10O3/c1-8-4-5-2-3-6(7)9-5/h5H,2-4H2,1H3/t5-/m0/s1
InChIKeyMUIZJRMCSRLKFM-YFKPBYRVSA-N
MW130.14 g/mol
LogP0.34
Rot. Bonds2

About (5S)-5-(methoxymethyl)oxolan-2-one

(5S)-5-(methoxymethyl)oxolan-2-one (PubChem CID 14768494) has the molecular formula C6H10O3 and a molecular weight of 130.14 g/mol. Its IUPAC name is (5S)-5-(methoxymethyl)oxolan-2-one.

Molecular Properties

Compound Name(5S)-5-(methoxymethyl)oxolan-2-one
PubChem CID14768494
Molecular FormulaC6H10O3
Molecular Weight130.14 g/mol
Exact Mass130.06
IUPAC Name(5S)-5-(methoxymethyl)oxolan-2-one
SMILESCOC[C@@H]1CCC(=O)O1
InChIInChI=1S/C6H10O3/c1-8-4-5-2-3-6(7)9-5/h5H,2-4H2,1H3/t5-/m0/s1
InChIKeyMUIZJRMCSRLKFM-YFKPBYRVSA-N
XLogP0.34
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.14
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-(methoxymethyl)oxolan-2-one?
The IUPAC name of (5S)-5-(methoxymethyl)oxolan-2-one (CID 14768494) is (5S)-5-(methoxymethyl)oxolan-2-one.
What is the SMILES notation for (5S)-5-(methoxymethyl)oxolan-2-one?
The canonical SMILES for (5S)-5-(methoxymethyl)oxolan-2-one is COC[C@@H]1CCC(=O)O1.
What is the InChIKey of (5S)-5-(methoxymethyl)oxolan-2-one?
The InChIKey is MUIZJRMCSRLKFM-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H10O3/c1-8-4-5-2-3-6(7)9-5/h5H,2-4H2,1H3/t5-/m0/s1.
What are the key properties of (5S)-5-(methoxymethyl)oxolan-2-one?
(5S)-5-(methoxymethyl)oxolan-2-one has a molecular weight of 130.14 g/mol, XLogP of 0.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-(methoxymethyl)oxolan-2-one is sourced from PubChem (CID 14768494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).