2-methyl-3-(oxiran-2-ylmethoxy)oxetane

C7H12O3 — CID 175220948

IUPAC2-methyl-3-(oxiran-2-ylmethoxy)oxetane
SMILESCC1OCC1OCC1CO1
InChIInChI=1S/C7H12O3/c1-5-7(4-8-5)10-3-6-2-9-6/h5-7H,2-4H2,1H3
InChIKeyGHPRXOPJUKAWDN-UHFFFAOYSA-N
MW144.17 g/mol
LogP0.19
Rot. Bonds3

About 2-methyl-3-(oxiran-2-ylmethoxy)oxetane

2-methyl-3-(oxiran-2-ylmethoxy)oxetane (PubChem CID 175220948) has the molecular formula C7H12O3 and a molecular weight of 144.17 g/mol. Its IUPAC name is 2-methyl-3-(oxiran-2-ylmethoxy)oxetane.

Molecular Properties

Compound Name2-methyl-3-(oxiran-2-ylmethoxy)oxetane
PubChem CID175220948
Molecular FormulaC7H12O3
Molecular Weight144.17 g/mol
Exact Mass144.08
IUPAC Name2-methyl-3-(oxiran-2-ylmethoxy)oxetane
SMILESCC1OCC1OCC1CO1
InChIInChI=1S/C7H12O3/c1-5-7(4-8-5)10-3-6-2-9-6/h5-7H,2-4H2,1H3
InChIKeyGHPRXOPJUKAWDN-UHFFFAOYSA-N
XLogP0.19
TPSA30.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(6R)-3,6-bis(oxiran-2-ylmethoxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 163672850
(3S,3aR,6S,6aR)-3,6-bis(oxiran-2-ylmethoxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 21139666
(2R)-2-[[(1R,2S)-2-[[(2S)-oxiran-2-yl]methoxy]cyclohexyl]oxymethyl]oxirane
CID 129448945
2-[[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylcyclohexyl)cyclohexyl]oxymethyl]oxirane
CID 20656027
(3S,3aR,6R,6aR)-6-(oxiran-2-ylmethoxy)-3-prop-2-enoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 72700333
2-methylsulfanyl-6-(oxiran-2-ylmethoxy)-7-oxabicyclo[2.2.1]heptane
CID 89213655
3-(oxiran-2-ylmethoxy)oxiran-2-ol
CID 141311016
diiodovanadium;2-(methoxymethyl)oxirane
CID 158509470
6,7-bis(oxiran-2-ylmethoxy)-3,8-dioxatricyclo[3.2.1.02,4]octane
CID 59502485
CID 59015329
CID 59015329
(2S,3S)-2,3-dimethyloxetane
CID 76764483
2-(oxiran-2-ylmethoxy)-7-oxabicyclo[2.2.1]heptane
CID 59502486

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(oxiran-2-ylmethoxy)oxetane?
The IUPAC name of 2-methyl-3-(oxiran-2-ylmethoxy)oxetane (CID 175220948) is 2-methyl-3-(oxiran-2-ylmethoxy)oxetane.
What is the SMILES notation for 2-methyl-3-(oxiran-2-ylmethoxy)oxetane?
The canonical SMILES for 2-methyl-3-(oxiran-2-ylmethoxy)oxetane is CC1OCC1OCC1CO1.
What is the InChIKey of 2-methyl-3-(oxiran-2-ylmethoxy)oxetane?
The InChIKey is GHPRXOPJUKAWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O3/c1-5-7(4-8-5)10-3-6-2-9-6/h5-7H,2-4H2,1H3.
What are the key properties of 2-methyl-3-(oxiran-2-ylmethoxy)oxetane?
2-methyl-3-(oxiran-2-ylmethoxy)oxetane has a molecular weight of 144.17 g/mol, XLogP of 0.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(oxiran-2-ylmethoxy)oxetane is sourced from PubChem (CID 175220948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).