ethane;methoxyethane;2-methylpropane

C9H24O — CID 144654475

IUPACethane;methoxyethane;2-methylpropane
SMILESCC.CC(C)C.CCOC
InChIInChI=1S/C4H10.C3H8O.C2H6/c1-4(2)3;1-3-4-2;1-2/h4H,1-3H3;3H2,1-2H3;1-2H3
InChIKeyIJOBGLJXHAICRD-UHFFFAOYSA-N
MW148.29 g/mol
LogP3.34
Rot. Bonds1

About ethane;methoxyethane;2-methylpropane

ethane;methoxyethane;2-methylpropane (PubChem CID 144654475) has the molecular formula C9H24O and a molecular weight of 148.29 g/mol. Its IUPAC name is ethane;methoxyethane;2-methylpropane.

Molecular Properties

Compound Nameethane;methoxyethane;2-methylpropane
PubChem CID144654475
Molecular FormulaC9H24O
Molecular Weight148.29 g/mol
Exact Mass148.18
IUPAC Nameethane;methoxyethane;2-methylpropane
SMILESCC.CC(C)C.CCOC
InChIInChI=1S/C4H10.C3H8O.C2H6/c1-4(2)3;1-3-4-2;1-2/h4H,1-3H3;3H2,1-2H3;1-2H3
InChIKeyIJOBGLJXHAICRD-UHFFFAOYSA-N
XLogP3.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.29
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;methoxyethane;2-methylpropane?
The IUPAC name of ethane;methoxyethane;2-methylpropane (CID 144654475) is ethane;methoxyethane;2-methylpropane.
What is the SMILES notation for ethane;methoxyethane;2-methylpropane?
The canonical SMILES for ethane;methoxyethane;2-methylpropane is CC.CC(C)C.CCOC.
What is the InChIKey of ethane;methoxyethane;2-methylpropane?
The InChIKey is IJOBGLJXHAICRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10.C3H8O.C2H6/c1-4(2)3;1-3-4-2;1-2/h4H,1-3H3;3H2,1-2H3;1-2H3.
What are the key properties of ethane;methoxyethane;2-methylpropane?
ethane;methoxyethane;2-methylpropane has a molecular weight of 148.29 g/mol, XLogP of 3.34, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methoxyethane;2-methylpropane is sourced from PubChem (CID 144654475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).