2-ethyloxolane;2-methylprop-1-ene

C10H20O — CID 178155271

IUPAC2-ethyloxolane;2-methylprop-1-ene
SMILESC=C(C)C.CCC1CCCO1
InChIInChI=1S/C6H12O.C4H8/c1-2-6-4-3-5-7-6;1-4(2)3/h6H,2-5H2,1H3;1H2,2-3H3
InChIKeyQZJXBKXKHLXBEK-UHFFFAOYSA-N
MW156.27 g/mol
LogP3.16
Rot. Bonds1

About 2-ethyloxolane;2-methylprop-1-ene

2-ethyloxolane;2-methylprop-1-ene (PubChem CID 178155271) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-ethyloxolane;2-methylprop-1-ene.

Molecular Properties

Compound Name2-ethyloxolane;2-methylprop-1-ene
PubChem CID178155271
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name2-ethyloxolane;2-methylprop-1-ene
SMILESC=C(C)C.CCC1CCCO1
InChIInChI=1S/C6H12O.C4H8/c1-2-6-4-3-5-7-6;1-4(2)3/h6H,2-5H2,1H3;1H2,2-3H3
InChIKeyQZJXBKXKHLXBEK-UHFFFAOYSA-N
XLogP3.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-ethyloxolane;2-methylprop-1-ene?
The IUPAC name of 2-ethyloxolane;2-methylprop-1-ene (CID 178155271) is 2-ethyloxolane;2-methylprop-1-ene.
What is the SMILES notation for 2-ethyloxolane;2-methylprop-1-ene?
The canonical SMILES for 2-ethyloxolane;2-methylprop-1-ene is C=C(C)C.CCC1CCCO1.
What is the InChIKey of 2-ethyloxolane;2-methylprop-1-ene?
The InChIKey is QZJXBKXKHLXBEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O.C4H8/c1-2-6-4-3-5-7-6;1-4(2)3/h6H,2-5H2,1H3;1H2,2-3H3.
What are the key properties of 2-ethyloxolane;2-methylprop-1-ene?
2-ethyloxolane;2-methylprop-1-ene has a molecular weight of 156.27 g/mol, XLogP of 3.16, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyloxolane;2-methylprop-1-ene is sourced from PubChem (CID 178155271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).