2,3-bis(ethenoxy)butane

C8H14O2 — CID 14533869

IUPAC2,3-bis(ethenoxy)butane
SMILESC=COC(C)C(C)OC=C
InChIInChI=1S/C8H14O2/c1-5-9-7(3)8(4)10-6-2/h5-8H,1-2H2,3-4H3
InChIKeyWJSSGRNOLJPGNJ-UHFFFAOYSA-N
MW142.20 g/mol
LogP2.08
Rot. Bonds5

About 2,3-bis(ethenoxy)butane

2,3-bis(ethenoxy)butane (PubChem CID 14533869) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 2,3-bis(ethenoxy)butane.

Molecular Properties

Compound Name2,3-bis(ethenoxy)butane
PubChem CID14533869
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name2,3-bis(ethenoxy)butane
SMILESC=COC(C)C(C)OC=C
InChIInChI=1S/C8H14O2/c1-5-9-7(3)8(4)10-6-2/h5-8H,1-2H2,3-4H3
InChIKeyWJSSGRNOLJPGNJ-UHFFFAOYSA-N
XLogP2.08
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 52.08
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 2,3-bis(ethenoxy)butane?
The IUPAC name of 2,3-bis(ethenoxy)butane (CID 14533869) is 2,3-bis(ethenoxy)butane.
What is the SMILES notation for 2,3-bis(ethenoxy)butane?
The canonical SMILES for 2,3-bis(ethenoxy)butane is C=COC(C)C(C)OC=C.
What is the InChIKey of 2,3-bis(ethenoxy)butane?
The InChIKey is WJSSGRNOLJPGNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-5-9-7(3)8(4)10-6-2/h5-8H,1-2H2,3-4H3.
What are the key properties of 2,3-bis(ethenoxy)butane?
2,3-bis(ethenoxy)butane has a molecular weight of 142.20 g/mol, XLogP of 2.08, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(ethenoxy)butane is sourced from PubChem (CID 14533869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).