2-methoxy-1-(2-propoxyethoxy)propane

C9H20O3 — CID 131970313

IUPAC2-methoxy-1-(2-propoxyethoxy)propane
SMILESCCCOCCOCC(C)OC
InChIInChI=1S/C9H20O3/c1-4-5-11-6-7-12-8-9(2)10-3/h9H,4-8H2,1-3H3
InChIKeyWZKWGBVPZWHLSL-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.46
Rot. Bonds8

About 2-methoxy-1-(2-propoxyethoxy)propane

2-methoxy-1-(2-propoxyethoxy)propane (PubChem CID 131970313) has the molecular formula C9H20O3 and a molecular weight of 176.26 g/mol. Its IUPAC name is 2-methoxy-1-(2-propoxyethoxy)propane.

Molecular Properties

Compound Name2-methoxy-1-(2-propoxyethoxy)propane
PubChem CID131970313
Molecular FormulaC9H20O3
Molecular Weight176.26 g/mol
Exact Mass176.14
IUPAC Name2-methoxy-1-(2-propoxyethoxy)propane
SMILESCCCOCCOCC(C)OC
InChIInChI=1S/C9H20O3/c1-4-5-11-6-7-12-8-9(2)10-3/h9H,4-8H2,1-3H3
InChIKeyWZKWGBVPZWHLSL-UHFFFAOYSA-N
XLogP1.46
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-1-(2-propoxypropoxy)propane
CID 174155722
2-methyl-2-[1-(2-propoxyethoxy)propan-2-yloxy]propane
CID 121485807
2-propoxy-1-[2-(2-propoxypropoxy)ethoxy]propane
CID 87065837
1,2-dimethoxypropane;1-(2-ethoxyethoxy)-2-methoxyethane
CID 158715782
5-methoxy-N-methyl-1-propoxyhexan-2-amine
CID 105165354
N-methyl-1-(2-propoxyethoxy)propan-2-amine
CID 63686556
2-(1-propoxypropan-2-yloxy)ethanol
CID 59676189
1-(1-propoxypropan-2-yloxy)pentane
CID 154093458
1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane
CID 158788669
2-[1-(2-propoxyethoxy)propan-2-yloxymethyl]oxirane
CID 134464354
1,2-dimethoxypropane;ytterbium
CID 175853617
1,2-dimethoxypropane;thulium
CID 175866702

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-propoxyethoxy)propane?
The IUPAC name of 2-methoxy-1-(2-propoxyethoxy)propane (CID 131970313) is 2-methoxy-1-(2-propoxyethoxy)propane.
What is the SMILES notation for 2-methoxy-1-(2-propoxyethoxy)propane?
The canonical SMILES for 2-methoxy-1-(2-propoxyethoxy)propane is CCCOCCOCC(C)OC.
What is the InChIKey of 2-methoxy-1-(2-propoxyethoxy)propane?
The InChIKey is WZKWGBVPZWHLSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O3/c1-4-5-11-6-7-12-8-9(2)10-3/h9H,4-8H2,1-3H3.
What are the key properties of 2-methoxy-1-(2-propoxyethoxy)propane?
2-methoxy-1-(2-propoxyethoxy)propane has a molecular weight of 176.26 g/mol, XLogP of 1.46, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-propoxyethoxy)propane is sourced from PubChem (CID 131970313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).