2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane

C11H22O2 — CID 155414756

IUPAC2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane
SMILESC=C(C)OC.CC=COC(C)(C)C
InChIInChI=1S/C7H14O.C4H8O/c1-5-6-8-7(2,3)4;1-4(2)5-3/h5-6H,1-4H3;1H2,2-3H3
InChIKeyAXLGKAUEYXMXSZ-UHFFFAOYSA-N
MW186.29 g/mol
LogP3.50
Rot. Bonds2

About 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane

2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane (PubChem CID 155414756) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane.

Molecular Properties

Compound Name2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane
PubChem CID155414756
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane
SMILESC=C(C)OC.CC=COC(C)(C)C
InChIInChI=1S/C7H14O.C4H8O/c1-5-6-8-7(2,3)4;1-4(2)5-3/h5-6H,1-4H3;1H2,2-3H3
InChIKeyAXLGKAUEYXMXSZ-UHFFFAOYSA-N
XLogP3.50
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane?
The IUPAC name of 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane (CID 155414756) is 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane.
What is the SMILES notation for 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane?
The canonical SMILES for 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane is C=C(C)OC.CC=COC(C)(C)C.
What is the InChIKey of 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane?
The InChIKey is AXLGKAUEYXMXSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O.C4H8O/c1-5-6-8-7(2,3)4;1-4(2)5-3/h5-6H,1-4H3;1H2,2-3H3.
What are the key properties of 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane?
2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane has a molecular weight of 186.29 g/mol, XLogP of 3.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyprop-1-ene;2-methyl-2-prop-1-enoxypropane is sourced from PubChem (CID 155414756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).