3-ethyl-1-(1-methoxyethoxy)hexane

C11H24O2 — CID 145144290

IUPAC3-ethyl-1-(1-methoxyethoxy)hexane
SMILESCCCC(CC)CCOC(C)OC
InChIInChI=1S/C11H24O2/c1-5-7-11(6-2)8-9-13-10(3)12-4/h10-11H,5-9H2,1-4H3
InChIKeyZSLDRSCLDKUKOC-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.21
Rot. Bonds8

About 3-ethyl-1-(1-methoxyethoxy)hexane

3-ethyl-1-(1-methoxyethoxy)hexane (PubChem CID 145144290) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 3-ethyl-1-(1-methoxyethoxy)hexane.

Molecular Properties

Compound Name3-ethyl-1-(1-methoxyethoxy)hexane
PubChem CID145144290
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name3-ethyl-1-(1-methoxyethoxy)hexane
SMILESCCCC(CC)CCOC(C)OC
InChIInChI=1S/C11H24O2/c1-5-7-11(6-2)8-9-13-10(3)12-4/h10-11H,5-9H2,1-4H3
InChIKeyZSLDRSCLDKUKOC-UHFFFAOYSA-N
XLogP3.21
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 ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

4-ethylheptane;methane
CID 143165373
ethane;3-ethyl-1-(methoxymethoxy)hexane
CID 145144305
1,4-bis(1-methoxyethoxy)butane
CID 20578725
3-(1-methoxyethoxy)hexane
CID 145051636
3-ethylhexyl hydrogen sulfite
CID 174958639
(3S)-1-[(2R)-butan-2-yl]oxy-3-methoxyhexane
CID 89015746
3-(chloromethyl)-1-propan-2-yloxyhexane
CID 66035666
CID 171374592
CID 171374592
1-[1-(1-methoxyethoxy)ethoxy]butane
CID 22025807
2-(1-methoxyethoxy)ethyl 3,4-dimethyloctanoate
CID 20729081
1-(1-methoxyethoxymethoxy)undecane
CID 88750695
1,1-dimethoxyethane;1-ethoxy-1-methoxyethane
CID 175467857

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(1-methoxyethoxy)hexane?
The IUPAC name of 3-ethyl-1-(1-methoxyethoxy)hexane (CID 145144290) is 3-ethyl-1-(1-methoxyethoxy)hexane.
What is the SMILES notation for 3-ethyl-1-(1-methoxyethoxy)hexane?
The canonical SMILES for 3-ethyl-1-(1-methoxyethoxy)hexane is CCCC(CC)CCOC(C)OC.
What is the InChIKey of 3-ethyl-1-(1-methoxyethoxy)hexane?
The InChIKey is ZSLDRSCLDKUKOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2/c1-5-7-11(6-2)8-9-13-10(3)12-4/h10-11H,5-9H2,1-4H3.
What are the key properties of 3-ethyl-1-(1-methoxyethoxy)hexane?
3-ethyl-1-(1-methoxyethoxy)hexane has a molecular weight of 188.31 g/mol, XLogP of 3.21, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(1-methoxyethoxy)hexane is sourced from PubChem (CID 145144290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).