3-(1-ethoxyethoxy)-3-methylpent-1-ene

C10H20O2 — CID 134937261

IUPAC3-(1-ethoxyethoxy)-3-methylpent-1-ene
SMILESC=CC(C)(CC)OC(C)OCC
InChIInChI=1S/C10H20O2/c1-6-10(5,7-2)12-9(4)11-8-3/h6,9H,1,7-8H2,2-5H3
InChIKeyXEDLVWXIVSZDTM-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.74
Rot. Bonds6

About 3-(1-ethoxyethoxy)-3-methylpent-1-ene

3-(1-ethoxyethoxy)-3-methylpent-1-ene (PubChem CID 134937261) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 3-(1-ethoxyethoxy)-3-methylpent-1-ene.

Molecular Properties

Compound Name3-(1-ethoxyethoxy)-3-methylpent-1-ene
PubChem CID134937261
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name3-(1-ethoxyethoxy)-3-methylpent-1-ene
SMILESC=CC(C)(CC)OC(C)OCC
InChIInChI=1S/C10H20O2/c1-6-10(5,7-2)12-9(4)11-8-3/h6,9H,1,7-8H2,2-5H3
InChIKeyXEDLVWXIVSZDTM-UHFFFAOYSA-N
XLogP2.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(1-Ethoxyethoxy)-3-methyl-1-penten-4-yne
CID 11105756
3-(1-Butoxy-2-iodoethoxy)-3-methylbut-1-ene
CID 11232190
1-Butene, 3-methyl-3-(1-ethoxyethoxy)
CID 550067
1-Butene, 3-[(1-ethoxy-2-propynyl)oxy]-3-methyl-
CID 10986651
Acrolein butyl t-butyl acetal
CID 129806096
3-(1-Ethoxyethoxy)but-1-ene
CID 13948124
3,3-Bis[(2-methylpropan-2-yl)oxy]but-1-ene
CID 18681797
2-Methyl-2-[1-[(2-methylpropan-2-yl)oxy]prop-2-enoxy]propane
CID 18988590
3,3-Diethoxybut-1-ene
CID 20380149
3,3-Diethoxypent-1-ene
CID 23451594
3-(2-Methoxypropan-2-yloxy)-3-methylbut-1-ene
CID 46221333
2-(1-Ethoxyprop-2-enylperoxy)-2-methylbutane
CID 57065616

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethoxyethoxy)-3-methylpent-1-ene?
The IUPAC name of 3-(1-ethoxyethoxy)-3-methylpent-1-ene (CID 134937261) is 3-(1-ethoxyethoxy)-3-methylpent-1-ene.
What is the SMILES notation for 3-(1-ethoxyethoxy)-3-methylpent-1-ene?
The canonical SMILES for 3-(1-ethoxyethoxy)-3-methylpent-1-ene is C=CC(C)(CC)OC(C)OCC.
What is the InChIKey of 3-(1-ethoxyethoxy)-3-methylpent-1-ene?
The InChIKey is XEDLVWXIVSZDTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-6-10(5,7-2)12-9(4)11-8-3/h6,9H,1,7-8H2,2-5H3.
What are the key properties of 3-(1-ethoxyethoxy)-3-methylpent-1-ene?
3-(1-ethoxyethoxy)-3-methylpent-1-ene has a molecular weight of 172.27 g/mol, XLogP of 2.74, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethoxyethoxy)-3-methylpent-1-ene is sourced from PubChem (CID 134937261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).