2-ethoxytetradecan-2-ol

C16H34O2 — CID 154401470

IUPAC2-ethoxytetradecan-2-ol
SMILESCCCCCCCCCCCCC(C)(O)OCC
InChIInChI=1S/C16H34O2/c1-4-6-7-8-9-10-11-12-13-14-15-16(3,17)18-5-2/h17H,4-15H2,1-3H3
InChIKeyMGFLDYLMFKXLFH-UHFFFAOYSA-N
MW258.45 g/mol
LogP5.04
Rot. Bonds13

About 2-ethoxytetradecan-2-ol

2-ethoxytetradecan-2-ol (PubChem CID 154401470) has the molecular formula C16H34O2 and a molecular weight of 258.45 g/mol. Its IUPAC name is 2-ethoxytetradecan-2-ol.

Molecular Properties

Compound Name2-ethoxytetradecan-2-ol
PubChem CID154401470
Molecular FormulaC16H34O2
Molecular Weight258.45 g/mol
Exact Mass258.26
IUPAC Name2-ethoxytetradecan-2-ol
SMILESCCCCCCCCCCCCC(C)(O)OCC
InChIInChI=1S/C16H34O2/c1-4-6-7-8-9-10-11-12-13-14-15-16(3,17)18-5-2/h17H,4-15H2,1-3H3
InChIKeyMGFLDYLMFKXLFH-UHFFFAOYSA-N
XLogP5.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.45
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

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CID 89439020
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4-(triethoxymethyl)dodecan-4-ol
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2,3,3-trimethylnonan-2-ol
CID 149434403
ruthenium;1,1,1-triethoxydecane
CID 157324278
3-ethoxy-2-methylundecan-3-ol
CID 141088800
2-methyldodecan-2-ol
CID 547702
13-methylheptacosan-13-ol
CID 87343529
2-(2-methylbutan-2-yloxy)heptan-2-ol
CID 130236683
2-ethoxy-2-methylnonanoic acid
CID 78969453
3,3-dimethyloctane-2,2-diol
CID 175169414
9-heptoxy-9-methylhenicosane
CID 91127088

Frequently Asked Questions

What is the IUPAC name of 2-ethoxytetradecan-2-ol?
The IUPAC name of 2-ethoxytetradecan-2-ol (CID 154401470) is 2-ethoxytetradecan-2-ol.
What is the SMILES notation for 2-ethoxytetradecan-2-ol?
The canonical SMILES for 2-ethoxytetradecan-2-ol is CCCCCCCCCCCCC(C)(O)OCC.
What is the InChIKey of 2-ethoxytetradecan-2-ol?
The InChIKey is MGFLDYLMFKXLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2/c1-4-6-7-8-9-10-11-12-13-14-15-16(3,17)18-5-2/h17H,4-15H2,1-3H3.
What are the key properties of 2-ethoxytetradecan-2-ol?
2-ethoxytetradecan-2-ol has a molecular weight of 258.45 g/mol, XLogP of 5.04, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxytetradecan-2-ol is sourced from PubChem (CID 154401470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).