1-(2-butan-2-yloxyethoxy)-3-methylbutane

C11H24O2 — CID 165127882

IUPAC1-(2-butan-2-yloxyethoxy)-3-methylbutane
SMILESCCC(C)OCCOCCC(C)C
InChIInChI=1S/C11H24O2/c1-5-11(4)13-9-8-12-7-6-10(2)3/h10-11H,5-9H2,1-4H3
InChIKeyPDGAAJWNGMTYIX-UHFFFAOYSA-N
MW188.31 g/mol
LogP2.86
Rot. Bonds8

About 1-(2-butan-2-yloxyethoxy)-3-methylbutane

1-(2-butan-2-yloxyethoxy)-3-methylbutane (PubChem CID 165127882) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 1-(2-butan-2-yloxyethoxy)-3-methylbutane.

Molecular Properties

Compound Name1-(2-butan-2-yloxyethoxy)-3-methylbutane
PubChem CID165127882
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name1-(2-butan-2-yloxyethoxy)-3-methylbutane
SMILESCCC(C)OCCOCCC(C)C
InChIInChI=1S/C11H24O2/c1-5-11(4)13-9-8-12-7-6-10(2)3/h10-11H,5-9H2,1-4H3
InChIKeyPDGAAJWNGMTYIX-UHFFFAOYSA-N
XLogP2.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 52.86
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

3-methyl-1-[2-[2-[2-[2-[2-(3-methylbutoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butane
CID 118631027
gallane;3-methyl-1-(3-methylbutoxy)butane
CID 174967258
3-methyl-1-(3-methylbutoxy)butane;molecular iodine
CID 131712143
1-[2-(2-butoxyethoxy)ethoxy]-3-methylbutane
CID 88620736
3-(2-butan-2-yloxyethoxy)propan-1-amine
CID 88947745
3-methyl-1-[2-(2-methylpropoxy)ethoxy]butane
CID 90326526
1-(2-ethoxyethoxy)-3-methylbutane;1-(3-ethoxypropoxy)-3-methylbutane
CID 161271742
1-(3-methylbutoxy)pentan-3-amine
CID 62599909
2-[2-(2-butan-2-yloxyethoxy)ethoxy]ethyl formate
CID 139655550
2-[2-[2-[2-[2-(3-methylbutoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethylazanium
CID 142623254
2-[2-[2-[2-[2-[2-(3-methylbutoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 6428229
3-(2-butan-2-yloxyethoxy)propanoic acid
CID 59266758

Frequently Asked Questions

What is the IUPAC name of 1-(2-butan-2-yloxyethoxy)-3-methylbutane?
The IUPAC name of 1-(2-butan-2-yloxyethoxy)-3-methylbutane (CID 165127882) is 1-(2-butan-2-yloxyethoxy)-3-methylbutane.
What is the SMILES notation for 1-(2-butan-2-yloxyethoxy)-3-methylbutane?
The canonical SMILES for 1-(2-butan-2-yloxyethoxy)-3-methylbutane is CCC(C)OCCOCCC(C)C.
What is the InChIKey of 1-(2-butan-2-yloxyethoxy)-3-methylbutane?
The InChIKey is PDGAAJWNGMTYIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2/c1-5-11(4)13-9-8-12-7-6-10(2)3/h10-11H,5-9H2,1-4H3.
What are the key properties of 1-(2-butan-2-yloxyethoxy)-3-methylbutane?
1-(2-butan-2-yloxyethoxy)-3-methylbutane has a molecular weight of 188.31 g/mol, XLogP of 2.86, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-butan-2-yloxyethoxy)-3-methylbutane is sourced from PubChem (CID 165127882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).