2-(2-methylprop-2-enoxymethoxy)oxane

C10H18O3 — CID 20609720

IUPAC2-(2-methylprop-2-enoxymethoxy)oxane
SMILESC=C(C)COCOC1CCCCO1
InChIInChI=1S/C10H18O3/c1-9(2)7-11-8-13-10-5-3-4-6-12-10/h10H,1,3-8H2,2H3
InChIKeyVECBQFAPAXNXHT-UHFFFAOYSA-N
MW186.25 g/mol
LogP2.08
Rot. Bonds5

About 2-(2-methylprop-2-enoxymethoxy)oxane

2-(2-methylprop-2-enoxymethoxy)oxane (PubChem CID 20609720) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-(2-methylprop-2-enoxymethoxy)oxane.

Molecular Properties

Compound Name2-(2-methylprop-2-enoxymethoxy)oxane
PubChem CID20609720
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name2-(2-methylprop-2-enoxymethoxy)oxane
SMILESC=C(C)COCOC1CCCCO1
InChIInChI=1S/C10H18O3/c1-9(2)7-11-8-13-10-5-3-4-6-12-10/h10H,1,3-8H2,2H3
InChIKeyVECBQFAPAXNXHT-UHFFFAOYSA-N
XLogP2.08
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-Allyloxytetrahydropyran
CID 4532059
2-((2-Methyl-2-propenyl)oxy)tetrahydro-2H-pyran
CID 376761
Stannane, tributyl[1-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]ethenyl]-
CID 11373810
(2S)-2-prop-2-enoxyoxane
CID 7033617
2-[(E)-but-2-enoxy]oxane
CID 11788432
2-[(E)-2-methylbut-2-enoxy]tetrahydropyran
CID 12623536
2-(Buta-2,3-dien-1-yloxy)tetrahydro-2H-pyran
CID 12778572
1,1-Bis[(2-methylprop-2-en-1-yl)oxy]butane
CID 225389
2-[(Z)-3-methylpent-2-en-4-ynoxy]oxane
CID 11063007
2-[(E)-3-methylpent-2-en-4-ynoxy]oxane
CID 14733015
2-[(E)-2-methylpent-2-en-4-ynoxy]oxane
CID 10583524
3-Iodo-2-(3-methylbut-2-enoxy)oxane
CID 10891766

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylprop-2-enoxymethoxy)oxane?
The IUPAC name of 2-(2-methylprop-2-enoxymethoxy)oxane (CID 20609720) is 2-(2-methylprop-2-enoxymethoxy)oxane.
What is the SMILES notation for 2-(2-methylprop-2-enoxymethoxy)oxane?
The canonical SMILES for 2-(2-methylprop-2-enoxymethoxy)oxane is C=C(C)COCOC1CCCCO1.
What is the InChIKey of 2-(2-methylprop-2-enoxymethoxy)oxane?
The InChIKey is VECBQFAPAXNXHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3/c1-9(2)7-11-8-13-10-5-3-4-6-12-10/h10H,1,3-8H2,2H3.
What are the key properties of 2-(2-methylprop-2-enoxymethoxy)oxane?
2-(2-methylprop-2-enoxymethoxy)oxane has a molecular weight of 186.25 g/mol, XLogP of 2.08, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylprop-2-enoxymethoxy)oxane is sourced from PubChem (CID 20609720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).