ethane;2-ethyl-6-(methoxymethyl)oxane

C11H24O2 — CID 145297456

IUPACethane;2-ethyl-6-(methoxymethyl)oxane
SMILESCC.CCC1CCCC(COC)O1
InChIInChI=1S/C9H18O2.C2H6/c1-3-8-5-4-6-9(11-8)7-10-2;1-2/h8-9H,3-7H2,1-2H3;1-2H3
InChIKeyZVWCAWRTINGFBX-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.01
Rot. Bonds3

About ethane;2-ethyl-6-(methoxymethyl)oxane

ethane;2-ethyl-6-(methoxymethyl)oxane (PubChem CID 145297456) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is ethane;2-ethyl-6-(methoxymethyl)oxane.

Molecular Properties

Compound Nameethane;2-ethyl-6-(methoxymethyl)oxane
PubChem CID145297456
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Nameethane;2-ethyl-6-(methoxymethyl)oxane
SMILESCC.CCC1CCCC(COC)O1
InChIInChI=1S/C9H18O2.C2H6/c1-3-8-5-4-6-9(11-8)7-10-2;1-2/h8-9H,3-7H2,1-2H3;1-2H3
InChIKeyZVWCAWRTINGFBX-UHFFFAOYSA-N
XLogP3.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;2-ethyl-6-(methoxymethyl)oxane?
The IUPAC name of ethane;2-ethyl-6-(methoxymethyl)oxane (CID 145297456) is ethane;2-ethyl-6-(methoxymethyl)oxane.
What is the SMILES notation for ethane;2-ethyl-6-(methoxymethyl)oxane?
The canonical SMILES for ethane;2-ethyl-6-(methoxymethyl)oxane is CC.CCC1CCCC(COC)O1.
What is the InChIKey of ethane;2-ethyl-6-(methoxymethyl)oxane?
The InChIKey is ZVWCAWRTINGFBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2.C2H6/c1-3-8-5-4-6-9(11-8)7-10-2;1-2/h8-9H,3-7H2,1-2H3;1-2H3.
What are the key properties of ethane;2-ethyl-6-(methoxymethyl)oxane?
ethane;2-ethyl-6-(methoxymethyl)oxane has a molecular weight of 188.31 g/mol, XLogP of 3.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethyl-6-(methoxymethyl)oxane is sourced from PubChem (CID 145297456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).