3-[2-(2-methylpropoxy)ethoxy]propan-1-ol

C9H20O3 — CID 106448655

IUPAC3-[2-(2-methylpropoxy)ethoxy]propan-1-ol
SMILESCC(C)COCCOCCCO
InChIInChI=1S/C9H20O3/c1-9(2)8-12-7-6-11-5-3-4-10/h9-10H,3-8H2,1-2H3
InChIKeyWPOJICJRCHMIOV-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.06
Rot. Bonds8

About 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol

3-[2-(2-methylpropoxy)ethoxy]propan-1-ol (PubChem CID 106448655) has the molecular formula C9H20O3 and a molecular weight of 176.26 g/mol. Its IUPAC name is 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol.

Molecular Properties

Compound Name3-[2-(2-methylpropoxy)ethoxy]propan-1-ol
PubChem CID106448655
Molecular FormulaC9H20O3
Molecular Weight176.26 g/mol
Exact Mass176.14
IUPAC Name3-[2-(2-methylpropoxy)ethoxy]propan-1-ol
SMILESCC(C)COCCOCCCO
InChIInChI=1S/C9H20O3/c1-9(2)8-12-7-6-11-5-3-4-10/h9-10H,3-8H2,1-2H3
InChIKeyWPOJICJRCHMIOV-UHFFFAOYSA-N
XLogP1.06
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2-[2-[2-(2-methylpropoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 6428225
2-methyl-1-[3-(2-methylpropoxy)propoxy]propane
CID 22020669
6-[2-(2-methylpropoxy)ethoxy]hexane-1-thiol
CID 106451165
6-[2-(2-methylpropoxy)ethoxy]hexan-2-ol
CID 106448667
6-methyl-1-[2-(2-methylpropoxy)ethoxy]heptan-4-one
CID 159838894
ethane;1-[2-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]ethoxy]-2-methylpropane
CID 171646714
3-methyl-1-[3-(2-methylpropoxy)propoxy]butane
CID 171414218
3-[3-[3-[3-(3-hydroxypropoxy)propoxy]propoxy]propoxy]propan-1-ol
CID 15061564
3-methyl-1-[2-(2-methylpropoxy)ethoxy]butane
CID 90326526
3-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol
CID 91809447
2-methylpropyl 4-[2-[2-[2-(2-methylpropoxy)ethoxy]ethoxy]ethoxy]butanoate
CID 121469854
3-(2-methylhexoxy)propan-1-ol
CID 134975986

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol?
The IUPAC name of 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol (CID 106448655) is 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol.
What is the SMILES notation for 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol?
The canonical SMILES for 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol is CC(C)COCCOCCCO.
What is the InChIKey of 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol?
The InChIKey is WPOJICJRCHMIOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O3/c1-9(2)8-12-7-6-11-5-3-4-10/h9-10H,3-8H2,1-2H3.
What are the key properties of 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol?
3-[2-(2-methylpropoxy)ethoxy]propan-1-ol has a molecular weight of 176.26 g/mol, XLogP of 1.06, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methylpropoxy)ethoxy]propan-1-ol is sourced from PubChem (CID 106448655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).