2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane

C12H26O — CID 19786076

IUPAC2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane
SMILESCC(C)C(C)(C)OC(C)(C)C(C)C
InChIInChI=1S/C12H26O/c1-9(2)11(5,6)13-12(7,8)10(3)4/h9-10H,1-8H3
InChIKeyDVQWBWJZXBYZLA-UHFFFAOYSA-N
MW186.34 g/mol
LogP3.87
Rot. Bonds4

About 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane

2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane (PubChem CID 19786076) has the molecular formula C12H26O and a molecular weight of 186.34 g/mol. Its IUPAC name is 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane.

Molecular Properties

Compound Name2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane
PubChem CID19786076
Molecular FormulaC12H26O
Molecular Weight186.34 g/mol
Exact Mass186.20
IUPAC Name2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane
SMILESCC(C)C(C)(C)OC(C)(C)C(C)C
InChIInChI=1S/C12H26O/c1-9(2)11(5,6)13-12(7,8)10(3)4/h9-10H,1-8H3
InChIKeyDVQWBWJZXBYZLA-UHFFFAOYSA-N
XLogP3.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane?
The IUPAC name of 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane (CID 19786076) is 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane.
What is the SMILES notation for 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane?
The canonical SMILES for 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane is CC(C)C(C)(C)OC(C)(C)C(C)C.
What is the InChIKey of 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane?
The InChIKey is DVQWBWJZXBYZLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O/c1-9(2)11(5,6)13-12(7,8)10(3)4/h9-10H,1-8H3.
What are the key properties of 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane?
2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane has a molecular weight of 186.34 g/mol, XLogP of 3.87, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylbutan-2-yloxy)-2,3-dimethylbutane is sourced from PubChem (CID 19786076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).