2-(2-butoxyethoxy)-2,3-dimethylbutane

C12H26O2 — CID 175016826

IUPAC2-(2-butoxyethoxy)-2,3-dimethylbutane
SMILESCCCCOCCOC(C)(C)C(C)C
InChIInChI=1S/C12H26O2/c1-6-7-8-13-9-10-14-12(4,5)11(2)3/h11H,6-10H2,1-5H3
InChIKeyUGGXQLYICJRABT-UHFFFAOYSA-N
MW202.34 g/mol
LogP3.25
Rot. Bonds8

About 2-(2-butoxyethoxy)-2,3-dimethylbutane

2-(2-butoxyethoxy)-2,3-dimethylbutane (PubChem CID 175016826) has the molecular formula C12H26O2 and a molecular weight of 202.34 g/mol. Its IUPAC name is 2-(2-butoxyethoxy)-2,3-dimethylbutane.

Molecular Properties

Compound Name2-(2-butoxyethoxy)-2,3-dimethylbutane
PubChem CID175016826
Molecular FormulaC12H26O2
Molecular Weight202.34 g/mol
Exact Mass202.19
IUPAC Name2-(2-butoxyethoxy)-2,3-dimethylbutane
SMILESCCCCOCCOC(C)(C)C(C)C
InChIInChI=1S/C12H26O2/c1-6-7-8-13-9-10-14-12(4,5)11(2)3/h11H,6-10H2,1-5H3
InChIKeyUGGXQLYICJRABT-UHFFFAOYSA-N
XLogP3.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2,3-dimethylbutan-2-yloxy)decane
CID 172756117
1-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]hexane
CID 164583744
2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]-N,2-dimethylbutan-1-amine
CID 104566510
1-[2-(2-butoxyethylperoxy)ethoxy]butane
CID 19809275
1,10-bis(2-butoxyethoxy)decane
CID 90257337
1-[2-(2-propan-2-yloxyethoxy)ethoxy]butane
CID 71356467
1-[2-(2-butoxyethoxy)ethoxy]-3-methylbutane
CID 88620736
1-butoxy-4-(2-propoxypropan-2-yl)dodecane
CID 151293545
butane-2,3-diol;1-butoxybutane
CID 87169993
2-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2,3-dimethylbutanoic acid
CID 104565073
1-[4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]butoxy]-4-propoxybutane
CID 134553508
ethane;1-(2-propoxyethoxy)butane
CID 164535746

Frequently Asked Questions

What is the IUPAC name of 2-(2-butoxyethoxy)-2,3-dimethylbutane?
The IUPAC name of 2-(2-butoxyethoxy)-2,3-dimethylbutane (CID 175016826) is 2-(2-butoxyethoxy)-2,3-dimethylbutane.
What is the SMILES notation for 2-(2-butoxyethoxy)-2,3-dimethylbutane?
The canonical SMILES for 2-(2-butoxyethoxy)-2,3-dimethylbutane is CCCCOCCOC(C)(C)C(C)C.
What is the InChIKey of 2-(2-butoxyethoxy)-2,3-dimethylbutane?
The InChIKey is UGGXQLYICJRABT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2/c1-6-7-8-13-9-10-14-12(4,5)11(2)3/h11H,6-10H2,1-5H3.
What are the key properties of 2-(2-butoxyethoxy)-2,3-dimethylbutane?
2-(2-butoxyethoxy)-2,3-dimethylbutane has a molecular weight of 202.34 g/mol, XLogP of 3.25, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butoxyethoxy)-2,3-dimethylbutane is sourced from PubChem (CID 175016826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).