2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol

C24H50O5 — CID 139597047

IUPAC2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol
SMILESCCCCCCCCCCCCCCOCC(C)OCC(C)OCCOCCO
InChIInChI=1S/C24H50O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-17-27-21-23(2)29-22-24(3)28-20-19-26-18-16-25/h23-25H,4-22H2,1-3H3
InChIKeySEHOXZYWHHSOHN-UHFFFAOYSA-N
MW418.66 g/mol
LogP5.52
Rot. Bonds24

About 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol

2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol (PubChem CID 139597047) has the molecular formula C24H50O5 and a molecular weight of 418.66 g/mol. Its IUPAC name is 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol
PubChem CID139597047
Molecular FormulaC24H50O5
Molecular Weight418.66 g/mol
Exact Mass418.37
IUPAC Name2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol
SMILESCCCCCCCCCCCCCCOCC(C)OCC(C)OCCOCCO
InChIInChI=1S/C24H50O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-17-27-21-23(2)29-22-24(3)28-20-19-26-18-16-25/h23-25H,4-22H2,1-3H3
InChIKeySEHOXZYWHHSOHN-UHFFFAOYSA-N
XLogP5.52
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds24
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.66
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-[2-[2-[1-[1-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139594793
2-[2-[2-[2-[1-[1-[1-[1-[1-(1-tridecoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139596809
2-[2-[2-[2-[1-[1-[1-[1-(1-dodecoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139596934
2-[2-[1-[1-[1-[1-(1-dodecoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]ethoxy]ethanol
CID 139597772
2-[2-[2-[2-[2-[2-[1-(1-hexadecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139597568
2-[2-[2-[2-[2-[1-[1-[1-(1-dodecoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139595319
2-[2-[1-[1-(1-pentadecoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]ethoxy]ethanol
CID 139596177
2-[2-[2-[2-[2-[1-[1-[1-[1-(1-tridecoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139594995
2-(1-octoxypropan-2-yloxy)ethanol
CID 59000352
2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 101170306
1-[1-[1-[1-(1-hexoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]decane
CID 150016958
1-[2-(2-decoxypropoxy)propoxy]decane
CID 19693399

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol (CID 139597047) is 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol is CCCCCCCCCCCCCCOCC(C)OCC(C)OCCOCCO.
What is the InChIKey of 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol?
The InChIKey is SEHOXZYWHHSOHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H50O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-17-27-21-23(2)29-22-24(3)28-20-19-26-18-16-25/h23-25H,4-22H2,1-3H3.
What are the key properties of 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol?
2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol has a molecular weight of 418.66 g/mol, XLogP of 5.52, 24 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol is sourced from PubChem (CID 139597047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).