2-(methoxymethyl)oxirane

C4H8O2 — CID 13589

IUPAC2-(methoxymethyl)oxirane
SMILESCOCC1CO1
InChIInChI=1S/C4H8O2/c1-5-2-4-3-6-4/h4H,2-3H2,1H3
InChIKeyLKMJVFRMDSNFRT-UHFFFAOYSA-N
MW88.11 g/mol
LogP0.03
Rot. Bonds2

About 2-(methoxymethyl)oxirane

2-(methoxymethyl)oxirane (PubChem CID 13589) has the molecular formula C4H8O2 and a molecular weight of 88.11 g/mol. Its IUPAC name is 2-(methoxymethyl)oxirane.

Molecular Properties

Compound Name2-(methoxymethyl)oxirane
PubChem CID13589
Molecular FormulaC4H8O2
Molecular Weight88.11 g/mol
Exact Mass88.05
IUPAC Name2-(methoxymethyl)oxirane
SMILESCOCC1CO1
InChIInChI=1S/C4H8O2/c1-5-2-4-3-6-4/h4H,2-3H2,1H3
InChIKeyLKMJVFRMDSNFRT-UHFFFAOYSA-N
XLogP0.03
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.11
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

Butyl glycidyl ether
CID 17049
2-((1-Methylethoxy)methyl)oxirane
CID 19920
2-((1,1-Dimethylethoxy)methyl)oxirane
CID 24314
Ethyl glycidyl ether
CID 19919
Propylene glycol dimethyl ether
CID 24509
1,2,3-Trimethoxypropane
CID 30210
2-((2-Methoxyethoxy)methyl)oxirane
CID 234734
(2R)-2-[(propan-2-yloxy)methyl]oxirane
CID 6993951
Oxirane, ((2-butoxyethoxy)methyl)-
CID 93080
(Isobutoxymethyl)oxirane
CID 98155
(2R)-2-(Methoxymethyl)oxirane
CID 2734441
2-(Methoxymethyl)-2-methyloxirane
CID 12084878

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)oxirane?
The IUPAC name of 2-(methoxymethyl)oxirane (CID 13589) is 2-(methoxymethyl)oxirane.
What is the SMILES notation for 2-(methoxymethyl)oxirane?
The canonical SMILES for 2-(methoxymethyl)oxirane is COCC1CO1.
What is the InChIKey of 2-(methoxymethyl)oxirane?
The InChIKey is LKMJVFRMDSNFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O2/c1-5-2-4-3-6-4/h4H,2-3H2,1H3.
What are the key properties of 2-(methoxymethyl)oxirane?
2-(methoxymethyl)oxirane has a molecular weight of 88.11 g/mol, XLogP of 0.03, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)oxirane is sourced from PubChem (CID 13589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).