2,4-dimethoxy-2,4-dimethylpentane

C9H20O2 — CID 19793679

IUPAC2,4-dimethoxy-2,4-dimethylpentane
SMILESCOC(C)(C)CC(C)(C)OC
InChIInChI=1S/C9H20O2/c1-8(2,10-5)7-9(3,4)11-6/h7H2,1-6H3
InChIKeyZUFQOOHGXWBRRE-UHFFFAOYSA-N
MW160.26 g/mol
LogP2.23
Rot. Bonds4

About 2,4-dimethoxy-2,4-dimethylpentane

2,4-dimethoxy-2,4-dimethylpentane (PubChem CID 19793679) has the molecular formula C9H20O2 and a molecular weight of 160.26 g/mol. Its IUPAC name is 2,4-dimethoxy-2,4-dimethylpentane.

Molecular Properties

Compound Name2,4-dimethoxy-2,4-dimethylpentane
PubChem CID19793679
Molecular FormulaC9H20O2
Molecular Weight160.26 g/mol
Exact Mass160.15
IUPAC Name2,4-dimethoxy-2,4-dimethylpentane
SMILESCOC(C)(C)CC(C)(C)OC
InChIInChI=1S/C9H20O2/c1-8(2,10-5)7-9(3,4)11-6/h7H2,1-6H3
InChIKeyZUFQOOHGXWBRRE-UHFFFAOYSA-N
XLogP2.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-2,4-dimethylpentane?
The IUPAC name of 2,4-dimethoxy-2,4-dimethylpentane (CID 19793679) is 2,4-dimethoxy-2,4-dimethylpentane.
What is the SMILES notation for 2,4-dimethoxy-2,4-dimethylpentane?
The canonical SMILES for 2,4-dimethoxy-2,4-dimethylpentane is COC(C)(C)CC(C)(C)OC.
What is the InChIKey of 2,4-dimethoxy-2,4-dimethylpentane?
The InChIKey is ZUFQOOHGXWBRRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2/c1-8(2,10-5)7-9(3,4)11-6/h7H2,1-6H3.
What are the key properties of 2,4-dimethoxy-2,4-dimethylpentane?
2,4-dimethoxy-2,4-dimethylpentane has a molecular weight of 160.26 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-2,4-dimethylpentane is sourced from PubChem (CID 19793679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).