2-(2-dodecan-2-yloxyethoxy)ethanol

C16H34O3 — CID 71420952

IUPAC2-(2-dodecan-2-yloxyethoxy)ethanol
SMILESCCCCCCCCCCC(C)OCCOCCO
InChIInChI=1S/C16H34O3/c1-3-4-5-6-7-8-9-10-11-16(2)19-15-14-18-13-12-17/h16-17H,3-15H2,1-2H3
InChIKeyRAFVNNPRGJPBFA-UHFFFAOYSA-N
MW274.44 g/mol
LogP3.93
Rot. Bonds15

About 2-(2-dodecan-2-yloxyethoxy)ethanol

2-(2-dodecan-2-yloxyethoxy)ethanol (PubChem CID 71420952) has the molecular formula C16H34O3 and a molecular weight of 274.44 g/mol. Its IUPAC name is 2-(2-dodecan-2-yloxyethoxy)ethanol.

Molecular Properties

Compound Name2-(2-dodecan-2-yloxyethoxy)ethanol
PubChem CID71420952
Molecular FormulaC16H34O3
Molecular Weight274.44 g/mol
Exact Mass274.25
IUPAC Name2-(2-dodecan-2-yloxyethoxy)ethanol
SMILESCCCCCCCCCCC(C)OCCOCCO
InChIInChI=1S/C16H34O3/c1-3-4-5-6-7-8-9-10-11-16(2)19-15-14-18-13-12-17/h16-17H,3-15H2,1-2H3
InChIKeyRAFVNNPRGJPBFA-UHFFFAOYSA-N
XLogP3.93
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.44
LogP ≤ 53.93
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-decan-2-yloxyethoxy)ethoxy]ethanol
CID 87813837
2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol
CID 23132047
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecan-6-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 87268686
2-(1-octan-2-yloxypropan-2-yloxy)ethanol
CID 20688305
2-[2-[2-(2-decan-3-yloxyethoxy)ethoxy]ethoxy]ethanol
CID 176652980
2-decan-2-yloxyethanol;sulfuric acid
CID 158151690
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-[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-[1-(1-tetradecoxypropan-2-yloxy)propan-2-yloxy]ethoxy]ethanol
CID 139597047
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

Frequently Asked Questions

What is the IUPAC name of 2-(2-dodecan-2-yloxyethoxy)ethanol?
The IUPAC name of 2-(2-dodecan-2-yloxyethoxy)ethanol (CID 71420952) is 2-(2-dodecan-2-yloxyethoxy)ethanol.
What is the SMILES notation for 2-(2-dodecan-2-yloxyethoxy)ethanol?
The canonical SMILES for 2-(2-dodecan-2-yloxyethoxy)ethanol is CCCCCCCCCCC(C)OCCOCCO.
What is the InChIKey of 2-(2-dodecan-2-yloxyethoxy)ethanol?
The InChIKey is RAFVNNPRGJPBFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O3/c1-3-4-5-6-7-8-9-10-11-16(2)19-15-14-18-13-12-17/h16-17H,3-15H2,1-2H3.
What are the key properties of 2-(2-dodecan-2-yloxyethoxy)ethanol?
2-(2-dodecan-2-yloxyethoxy)ethanol has a molecular weight of 274.44 g/mol, XLogP of 3.93, 15 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-dodecan-2-yloxyethoxy)ethanol is sourced from PubChem (CID 71420952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).