1-(2-methoxyethoxy)-2,5-dimethylhexane

C11H24O2 — CID 18720488

IUPAC1-(2-methoxyethoxy)-2,5-dimethylhexane
SMILESCOCCOCC(C)CCC(C)C
InChIInChI=1S/C11H24O2/c1-10(2)5-6-11(3)9-13-8-7-12-4/h10-11H,5-9H2,1-4H3
InChIKeyHZGANRVZHMQMCP-UHFFFAOYSA-N
MW188.31 g/mol
LogP2.72
Rot. Bonds8

About 1-(2-methoxyethoxy)-2,5-dimethylhexane

1-(2-methoxyethoxy)-2,5-dimethylhexane (PubChem CID 18720488) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 1-(2-methoxyethoxy)-2,5-dimethylhexane.

Molecular Properties

Compound Name1-(2-methoxyethoxy)-2,5-dimethylhexane
PubChem CID18720488
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name1-(2-methoxyethoxy)-2,5-dimethylhexane
SMILESCOCCOCC(C)CCC(C)C
InChIInChI=1S/C11H24O2/c1-10(2)5-6-11(3)9-13-8-7-12-4/h10-11H,5-9H2,1-4H3
InChIKeyHZGANRVZHMQMCP-UHFFFAOYSA-N
XLogP2.72
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 ≤ 52.72
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-Ethoxy-3-ethyl-5-methylhexane
CID 231562
2-(2-Methylhexoxy)ethanol
CID 22125988
Hexane, 1-(hexyloxy)-2-methyl-
CID 538287
Hexane, 1-(hexyloxy)-5-methyl-
CID 545572
1,6-Diethoxy-2,5-dimethylhexane
CID 121007544
2,5-Dimethyl-1-[2-(2-methylpropoxy)ethoxy]hexane
CID 18720487
1-Methoxy-2,5-dimethylhexane
CID 18720491
1-Methoxy-5-methylhexane
CID 19736995
1-Ethoxy-2-methylhexane
CID 19991834
3-Methoxy-2-propan-2-yloxolane
CID 20664835
2-Methyl-1-(2-methylhexoxy)hexane
CID 22151657
5-Methyl-1-(5-methylhexoxy)hexane
CID 22758033

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxy)-2,5-dimethylhexane?
The IUPAC name of 1-(2-methoxyethoxy)-2,5-dimethylhexane (CID 18720488) is 1-(2-methoxyethoxy)-2,5-dimethylhexane.
What is the SMILES notation for 1-(2-methoxyethoxy)-2,5-dimethylhexane?
The canonical SMILES for 1-(2-methoxyethoxy)-2,5-dimethylhexane is COCCOCC(C)CCC(C)C.
What is the InChIKey of 1-(2-methoxyethoxy)-2,5-dimethylhexane?
The InChIKey is HZGANRVZHMQMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2/c1-10(2)5-6-11(3)9-13-8-7-12-4/h10-11H,5-9H2,1-4H3.
What are the key properties of 1-(2-methoxyethoxy)-2,5-dimethylhexane?
1-(2-methoxyethoxy)-2,5-dimethylhexane has a molecular weight of 188.31 g/mol, XLogP of 2.72, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxy)-2,5-dimethylhexane is sourced from PubChem (CID 18720488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).