ethane;4-methoxy-2,4-dimethyloxane

C10H22O2 — CID 91588834

IUPACethane;4-methoxy-2,4-dimethyloxane
SMILESCC.COC1(C)CCOC(C)C1
InChIInChI=1S/C8H16O2.C2H6/c1-7-6-8(2,9-3)4-5-10-7;1-2/h7H,4-6H2,1-3H3;1-2H3
InChIKeyFWLNLZJKJURSII-UHFFFAOYSA-N
MW174.28 g/mol
LogP2.62
Rot. Bonds1

About ethane;4-methoxy-2,4-dimethyloxane

ethane;4-methoxy-2,4-dimethyloxane (PubChem CID 91588834) has the molecular formula C10H22O2 and a molecular weight of 174.28 g/mol. Its IUPAC name is ethane;4-methoxy-2,4-dimethyloxane.

Molecular Properties

Compound Nameethane;4-methoxy-2,4-dimethyloxane
PubChem CID91588834
Molecular FormulaC10H22O2
Molecular Weight174.28 g/mol
Exact Mass174.16
IUPAC Nameethane;4-methoxy-2,4-dimethyloxane
SMILESCC.COC1(C)CCOC(C)C1
InChIInChI=1S/C8H16O2.C2H6/c1-7-6-8(2,9-3)4-5-10-7;1-2/h7H,4-6H2,1-3H3;1-2H3
InChIKeyFWLNLZJKJURSII-UHFFFAOYSA-N
XLogP2.62
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.28
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;4-methoxy-2,4-dimethyloxane?
The IUPAC name of ethane;4-methoxy-2,4-dimethyloxane (CID 91588834) is ethane;4-methoxy-2,4-dimethyloxane.
What is the SMILES notation for ethane;4-methoxy-2,4-dimethyloxane?
The canonical SMILES for ethane;4-methoxy-2,4-dimethyloxane is CC.COC1(C)CCOC(C)C1.
What is the InChIKey of ethane;4-methoxy-2,4-dimethyloxane?
The InChIKey is FWLNLZJKJURSII-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2.C2H6/c1-7-6-8(2,9-3)4-5-10-7;1-2/h7H,4-6H2,1-3H3;1-2H3.
What are the key properties of ethane;4-methoxy-2,4-dimethyloxane?
ethane;4-methoxy-2,4-dimethyloxane has a molecular weight of 174.28 g/mol, XLogP of 2.62, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methoxy-2,4-dimethyloxane is sourced from PubChem (CID 91588834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).