methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene

C11H24O2 — CID 54499924

IUPACmethoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene
SMILESC=C(C)C.C=C(C)OC.CCOC
InChIInChI=1S/C4H8O.C4H8.C3H8O/c1-4(2)5-3;1-4(2)3;1-3-4-2/h1H2,2-3H3;1H2,2-3H3;3H2,1-2H3
InChIKeyYBSALCQENVZDBF-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.40
Rot. Bonds2

About methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene

methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene (PubChem CID 54499924) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene.

Molecular Properties

Compound Namemethoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene
PubChem CID54499924
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Namemethoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene
SMILESC=C(C)C.C=C(C)OC.CCOC
InChIInChI=1S/C4H8O.C4H8.C3H8O/c1-4(2)5-3;1-4(2)3;1-3-4-2/h1H2,2-3H3;1H2,2-3H3;3H2,1-2H3
InChIKeyYBSALCQENVZDBF-UHFFFAOYSA-N
XLogP3.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene?
The IUPAC name of methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene (CID 54499924) is methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene.
What is the SMILES notation for methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene?
The canonical SMILES for methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene is C=C(C)C.C=C(C)OC.CCOC.
What is the InChIKey of methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene?
The InChIKey is YBSALCQENVZDBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O.C4H8.C3H8O/c1-4(2)5-3;1-4(2)3;1-3-4-2/h1H2,2-3H3;1H2,2-3H3;3H2,1-2H3.
What are the key properties of methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene?
methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene has a molecular weight of 188.31 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene is sourced from PubChem (CID 54499924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).