2-(methoxymethyl)-5-methyl-2,5-dihydrofuran

C7H12O2 — CID 135174017

IUPAC2-(methoxymethyl)-5-methyl-2,5-dihydrofuran
SMILESCOCC1C=CC(C)O1
InChIInChI=1S/C7H12O2/c1-6-3-4-7(9-6)5-8-2/h3-4,6-7H,5H2,1-2H3
InChIKeyHMISWZSYWOIDMX-UHFFFAOYSA-N
MW128.17 g/mol
LogP0.98
Rot. Bonds2

About 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran

2-(methoxymethyl)-5-methyl-2,5-dihydrofuran (PubChem CID 135174017) has the molecular formula C7H12O2 and a molecular weight of 128.17 g/mol. Its IUPAC name is 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran.

Molecular Properties

Compound Name2-(methoxymethyl)-5-methyl-2,5-dihydrofuran
PubChem CID135174017
Molecular FormulaC7H12O2
Molecular Weight128.17 g/mol
Exact Mass128.08
IUPAC Name2-(methoxymethyl)-5-methyl-2,5-dihydrofuran
SMILESCOCC1C=CC(C)O1
InChIInChI=1S/C7H12O2/c1-6-3-4-7(9-6)5-8-2/h3-4,6-7H,5H2,1-2H3
InChIKeyHMISWZSYWOIDMX-UHFFFAOYSA-N
XLogP0.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2R)-2,5-dimethyl-2,5-dihydrofuran
CID 154537787
tert-butyl-[[(2S,5S)-5-methyl-2,5-dihydrofuran-2-yl]methoxy]-diphenylsilane
CID 46854165
(2R)-2-[(2S,5S)-5-(methoxymethyl)-2,5-dihydrofuran-2-yl]butanoic acid
CID 177463183
2,4,6-tris(methoxymethyl)-1,3,5-trioxane
CID 163692364
(2S,6R)-2-benzyl-6-(methoxymethyl)-3,6-dihydro-2H-pyran
CID 134930571
[(2R,3S,6S)-3-acetyloxy-6-methyl-3,6-dihydro-2H-pyran-2-yl]methyl acetate
CID 11264656
(2R,3S)-2,3-bis(methoxymethyl)-5-oxabicyclo[2.1.0]pentane
CID 102020985
2-(methoxymethyl)-3,4,5-trimethyloxolane
CID 21349670
(2S,6R)-2-(methoxymethyl)-6-methylmorpholine
CID 95252382
(1R,2R,4S,5S,6R,7S)-6,7-bis(methoxymethyl)-3,8-dioxatricyclo[3.2.1.02,4]octane
CID 11790205
2,5-bis(methoxymethyl)oxolane
CID 57041378
9,10-bis(methoxymethyl)tricyclo[4.2.2.02,5]deca-3,7-diene
CID 101038950

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran?
The IUPAC name of 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran (CID 135174017) is 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran.
What is the SMILES notation for 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran?
The canonical SMILES for 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran is COCC1C=CC(C)O1.
What is the InChIKey of 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran?
The InChIKey is HMISWZSYWOIDMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O2/c1-6-3-4-7(9-6)5-8-2/h3-4,6-7H,5H2,1-2H3.
What are the key properties of 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran?
2-(methoxymethyl)-5-methyl-2,5-dihydrofuran has a molecular weight of 128.17 g/mol, XLogP of 0.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-5-methyl-2,5-dihydrofuran is sourced from PubChem (CID 135174017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).