ethene;methoxyethane

C7H16O — CID 162163830

IUPACethene;methoxyethane
SMILESC=C.C=C.CCOC
InChIInChI=1S/C3H8O.2C2H4/c1-3-4-2;2*1-2/h3H2,1-2H3;2*1-2H2
InChIKeyZMVVVXNWHQEWCP-UHFFFAOYSA-N
MW116.20 g/mol
LogP2.26
Rot. Bonds1

About ethene;methoxyethane

ethene;methoxyethane (PubChem CID 162163830) has the molecular formula C7H16O and a molecular weight of 116.20 g/mol. Its IUPAC name is ethene;methoxyethane.

Molecular Properties

Compound Nameethene;methoxyethane
PubChem CID162163830
Molecular FormulaC7H16O
Molecular Weight116.20 g/mol
Exact Mass116.12
IUPAC Nameethene;methoxyethane
SMILESC=C.C=C.CCOC
InChIInChI=1S/C3H8O.2C2H4/c1-3-4-2;2*1-2/h3H2,1-2H3;2*1-2H2
InChIKeyZMVVVXNWHQEWCP-UHFFFAOYSA-N
XLogP2.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.20
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethene;methoxyethane?
The IUPAC name of ethene;methoxyethane (CID 162163830) is ethene;methoxyethane.
What is the SMILES notation for ethene;methoxyethane?
The canonical SMILES for ethene;methoxyethane is C=C.C=C.CCOC.
What is the InChIKey of ethene;methoxyethane?
The InChIKey is ZMVVVXNWHQEWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O.2C2H4/c1-3-4-2;2*1-2/h3H2,1-2H3;2*1-2H2.
What are the key properties of ethene;methoxyethane?
ethene;methoxyethane has a molecular weight of 116.20 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;methoxyethane is sourced from PubChem (CID 162163830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).