ethanol;2-methyl-1-(2-methylpropoxy)propane

C10H24O2 — CID 23506368

IUPACethanol;2-methyl-1-(2-methylpropoxy)propane
SMILESCC(C)COCC(C)C.CCO
InChIInChI=1S/C8H18O.C2H6O/c1-7(2)5-9-6-8(3)4;1-2-3/h7-8H,5-6H2,1-4H3;3H,2H2,1H3
InChIKeyBLTMZDJNFHLXCO-UHFFFAOYSA-N
MW176.30 g/mol
LogP2.31
Rot. Bonds4

About ethanol;2-methyl-1-(2-methylpropoxy)propane

ethanol;2-methyl-1-(2-methylpropoxy)propane (PubChem CID 23506368) has the molecular formula C10H24O2 and a molecular weight of 176.30 g/mol. Its IUPAC name is ethanol;2-methyl-1-(2-methylpropoxy)propane.

Molecular Properties

Compound Nameethanol;2-methyl-1-(2-methylpropoxy)propane
PubChem CID23506368
Molecular FormulaC10H24O2
Molecular Weight176.30 g/mol
Exact Mass176.18
IUPAC Nameethanol;2-methyl-1-(2-methylpropoxy)propane
SMILESCC(C)COCC(C)C.CCO
InChIInChI=1S/C8H18O.C2H6O/c1-7(2)5-9-6-8(3)4;1-2-3/h7-8H,5-6H2,1-4H3;3H,2H2,1H3
InChIKeyBLTMZDJNFHLXCO-UHFFFAOYSA-N
XLogP2.31
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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2-methyl-1-(2-methylpropoxy)propane;2-methyl-1-[2-(2-methylpropoxy)propoxy]propane;propane
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CID 174542269
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CID 15004701
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CID 175551749
2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine
CID 167710729
ethanol;ruthenium
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Frequently Asked Questions

What is the IUPAC name of ethanol;2-methyl-1-(2-methylpropoxy)propane?
The IUPAC name of ethanol;2-methyl-1-(2-methylpropoxy)propane (CID 23506368) is ethanol;2-methyl-1-(2-methylpropoxy)propane.
What is the SMILES notation for ethanol;2-methyl-1-(2-methylpropoxy)propane?
The canonical SMILES for ethanol;2-methyl-1-(2-methylpropoxy)propane is CC(C)COCC(C)C.CCO.
What is the InChIKey of ethanol;2-methyl-1-(2-methylpropoxy)propane?
The InChIKey is BLTMZDJNFHLXCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O.C2H6O/c1-7(2)5-9-6-8(3)4;1-2-3/h7-8H,5-6H2,1-4H3;3H,2H2,1H3.
What are the key properties of ethanol;2-methyl-1-(2-methylpropoxy)propane?
ethanol;2-methyl-1-(2-methylpropoxy)propane has a molecular weight of 176.30 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;2-methyl-1-(2-methylpropoxy)propane is sourced from PubChem (CID 23506368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).