2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane

C12H26O3 — CID 121485807

IUPAC2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane
SMILESCCCOCCOCC(C)OC(C)(C)C
InChIInChI=1S/C12H26O3/c1-6-7-13-8-9-14-10-11(2)15-12(3,4)5/h11H,6-10H2,1-5H3
InChIKeyBQEMICFJEKCNCK-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.63
Rot. Bonds8

About 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane

2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane (PubChem CID 121485807) has the molecular formula C12H26O3 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane.

Molecular Properties

Compound Name2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane
PubChem CID121485807
Molecular FormulaC12H26O3
Molecular Weight218.34 g/mol
Exact Mass218.19
IUPAC Name2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane
SMILESCCCOCCOCC(C)OC(C)(C)C
InChIInChI=1S/C12H26O3/c1-6-7-13-8-9-14-10-11(2)15-12(3,4)5/h11H,6-10H2,1-5H3
InChIKeyBQEMICFJEKCNCK-UHFFFAOYSA-N
XLogP2.63
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-1-(2-propoxyethoxy)propane
CID 131970313
2,2,4-trimethyl-4-[1-(1-propoxypropan-2-yloxy)propan-2-yloxy]pentane
CID 164583763
2-propoxy-1-[2-(2-propoxypropoxy)ethoxy]propane
CID 87065837
N-methyl-1-(2-propoxyethoxy)propan-2-amine
CID 63686556
2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane
CID 87735391
2-[1-(2-propoxyethoxy)propan-2-yloxymethyl]oxirane
CID 134464354
N-tert-butyl-2-methyl-3-(2-propoxyethoxy)propan-1-amine
CID 103074770
3-[(2-methylpropan-2-yl)oxy]-1-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]butane
CID 155769092
2-methyl-2-(2-methylpropoxy)-1-(2-propoxyethoxy)propane
CID 155206802
2-(1-propoxypropan-2-yloxy)ethanol
CID 59676189
1-(1-propoxypropan-2-yloxy)pentane
CID 154093458
1-cyclopropyl-N-methyl-2-(2-propoxyethoxy)ethanamine
CID 63907333

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane?
The IUPAC name of 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane (CID 121485807) is 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane.
What is the SMILES notation for 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane?
The canonical SMILES for 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane is CCCOCCOCC(C)OC(C)(C)C.
What is the InChIKey of 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane?
The InChIKey is BQEMICFJEKCNCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O3/c1-6-7-13-8-9-14-10-11(2)15-12(3,4)5/h11H,6-10H2,1-5H3.
What are the key properties of 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane?
2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane has a molecular weight of 218.34 g/mol, XLogP of 2.63, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane is sourced from PubChem (CID 121485807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).