2-(3-methoxypropoxy)-2-methylpropane

C8H18O2 — CID 13445097

IUPAC2-(3-methoxypropoxy)-2-methylpropane
SMILESCOCCCOC(C)(C)C
InChIInChI=1S/C8H18O2/c1-8(2,3)10-7-5-6-9-4/h5-7H2,1-4H3
InChIKeySPNYZIAJDUDUMR-UHFFFAOYSA-N
MW146.23 g/mol
LogP1.84
Rot. Bonds4

About 2-(3-methoxypropoxy)-2-methylpropane

2-(3-methoxypropoxy)-2-methylpropane (PubChem CID 13445097) has the molecular formula C8H18O2 and a molecular weight of 146.23 g/mol. Its IUPAC name is 2-(3-methoxypropoxy)-2-methylpropane.

Molecular Properties

Compound Name2-(3-methoxypropoxy)-2-methylpropane
PubChem CID13445097
Molecular FormulaC8H18O2
Molecular Weight146.23 g/mol
Exact Mass146.13
IUPAC Name2-(3-methoxypropoxy)-2-methylpropane
SMILESCOCCCOC(C)(C)C
InChIInChI=1S/C8H18O2/c1-8(2,3)10-7-5-6-9-4/h5-7H2,1-4H3
InChIKeySPNYZIAJDUDUMR-UHFFFAOYSA-N
XLogP1.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 51.84
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

6,6-dimethyl-1-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]heptane;6,6-dimethyl-1-[3-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]propoxy]heptane;methane;1-(3-methoxypropoxy)-6,6-dimethylheptane
CID 158388526
N-(2-methoxyethyl)-3-[(2-methylpropan-2-yl)oxy]propan-1-amine
CID 62597133
2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2-methylpropane
CID 134553507
3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propan-1-ol
CID 4077517
4-[(2-methylpropan-2-yl)oxy]butan-1-amine
CID 18672802
1-fluoro-4-[(2-methylpropan-2-yl)oxy]butane
CID 166005910
1-methoxy-3-[3-(3-methoxypropoxy)propoxy]propane
CID 6432627
7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane
CID 22907243
9-[(2-methylpropan-2-yl)oxy]nonane-1-thiol
CID 105344392
1-methoxy-2-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propan-2-amine
CID 115609397
3-methyl-1-[3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]propoxy]propoxy]butane
CID 139316697
1-ethoxy-5-[(2-methylpropan-2-yl)oxy]pentane
CID 88911131

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypropoxy)-2-methylpropane?
The IUPAC name of 2-(3-methoxypropoxy)-2-methylpropane (CID 13445097) is 2-(3-methoxypropoxy)-2-methylpropane.
What is the SMILES notation for 2-(3-methoxypropoxy)-2-methylpropane?
The canonical SMILES for 2-(3-methoxypropoxy)-2-methylpropane is COCCCOC(C)(C)C.
What is the InChIKey of 2-(3-methoxypropoxy)-2-methylpropane?
The InChIKey is SPNYZIAJDUDUMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2/c1-8(2,3)10-7-5-6-9-4/h5-7H2,1-4H3.
What are the key properties of 2-(3-methoxypropoxy)-2-methylpropane?
2-(3-methoxypropoxy)-2-methylpropane has a molecular weight of 146.23 g/mol, XLogP of 1.84, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypropoxy)-2-methylpropane is sourced from PubChem (CID 13445097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).