2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane

C11H22O3 — CID 15107751

IUPAC2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane
SMILESC=CCOCC(COC(C)(C)C)OC
InChIInChI=1S/C11H22O3/c1-6-7-13-8-10(12-5)9-14-11(2,3)4/h6,10H,1,7-9H2,2-5H3
InChIKeyIWRZJUWRLUHREU-UHFFFAOYSA-N
MW202.29 g/mol
LogP2.02
Rot. Bonds7

About 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane

2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane (PubChem CID 15107751) has the molecular formula C11H22O3 and a molecular weight of 202.29 g/mol. Its IUPAC name is 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane.

Molecular Properties

Compound Name2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane
PubChem CID15107751
Molecular FormulaC11H22O3
Molecular Weight202.29 g/mol
Exact Mass202.16
IUPAC Name2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane
SMILESC=CCOCC(COC(C)(C)C)OC
InChIInChI=1S/C11H22O3/c1-6-7-13-8-10(12-5)9-14-11(2,3)4/h6,10H,1,7-9H2,2-5H3
InChIKeyIWRZJUWRLUHREU-UHFFFAOYSA-N
XLogP2.02
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.29
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane?
The IUPAC name of 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane (CID 15107751) is 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane.
What is the SMILES notation for 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane?
The canonical SMILES for 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane is C=CCOCC(COC(C)(C)C)OC.
What is the InChIKey of 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane?
The InChIKey is IWRZJUWRLUHREU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3/c1-6-7-13-8-10(12-5)9-14-11(2,3)4/h6,10H,1,7-9H2,2-5H3.
What are the key properties of 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane?
2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane has a molecular weight of 202.29 g/mol, XLogP of 2.02, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-3-prop-2-enoxypropoxy)-2-methylpropane is sourced from PubChem (CID 15107751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).