1-ethoxy-14-(8-fluorooctoxy)tetradecane

C24H49FO2 — CID 139714700

IUPAC1-ethoxy-14-(8-fluorooctoxy)tetradecane
SMILESCCOCCCCCCCCCCCCCCOCCCCCCCCF
InChIInChI=1S/C24H49FO2/c1-2-26-22-18-14-10-7-5-3-4-6-8-11-15-19-23-27-24-20-16-12-9-13-17-21-25/h2-24H2,1H3
InChIKeyZHVDQRDXOWXJHG-UHFFFAOYSA-N
MW388.65 g/mol
LogP8.03
Rot. Bonds24

About 1-ethoxy-14-(8-fluorooctoxy)tetradecane

1-ethoxy-14-(8-fluorooctoxy)tetradecane (PubChem CID 139714700) has the molecular formula C24H49FO2 and a molecular weight of 388.65 g/mol. Its IUPAC name is 1-ethoxy-14-(8-fluorooctoxy)tetradecane.

Molecular Properties

Compound Name1-ethoxy-14-(8-fluorooctoxy)tetradecane
PubChem CID139714700
Molecular FormulaC24H49FO2
Molecular Weight388.65 g/mol
Exact Mass388.37
IUPAC Name1-ethoxy-14-(8-fluorooctoxy)tetradecane
SMILESCCOCCCCCCCCCCCCCCOCCCCCCCCF
InChIInChI=1S/C24H49FO2/c1-2-26-22-18-14-10-7-5-3-4-6-8-11-15-19-23-27-24-20-16-12-9-13-17-21-25/h2-24H2,1H3
InChIKeyZHVDQRDXOWXJHG-UHFFFAOYSA-N
XLogP8.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds24
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.65
LogP ≤ 58.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;1-fluoro-15-pentoxypentadecane
CID 145255757
1-fluoro-16-(2-fluoroethoxy)hexadecane
CID 155014928
1-fluoro-17-(2-fluoroethoxy)heptadecane
CID 155014984
1-(3-ethoxypropoxy)tetradecane
CID 91693148
3-(4-ethoxybutoxy)propan-1-amine
CID 87914179
3-ethoxy-N-(3-fluoropropyl)propan-1-amine
CID 81107172
4-ethoxybutoxymethanamine
CID 87914089
8-ethoxyoctyl(dimethyl)silane
CID 172779894
1-chloro-6-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]hexane
CID 89239780
1-(3-ethoxypropoxy)-4-methoxybutane
CID 59660847
1-chloro-14-ethoxytetradecane
CID 173330502
4-ethoxybutan-1-amine;hydrochloride
CID 87771260

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-14-(8-fluorooctoxy)tetradecane?
The IUPAC name of 1-ethoxy-14-(8-fluorooctoxy)tetradecane (CID 139714700) is 1-ethoxy-14-(8-fluorooctoxy)tetradecane.
What is the SMILES notation for 1-ethoxy-14-(8-fluorooctoxy)tetradecane?
The canonical SMILES for 1-ethoxy-14-(8-fluorooctoxy)tetradecane is CCOCCCCCCCCCCCCCCOCCCCCCCCF.
What is the InChIKey of 1-ethoxy-14-(8-fluorooctoxy)tetradecane?
The InChIKey is ZHVDQRDXOWXJHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H49FO2/c1-2-26-22-18-14-10-7-5-3-4-6-8-11-15-19-23-27-24-20-16-12-9-13-17-21-25/h2-24H2,1H3.
What are the key properties of 1-ethoxy-14-(8-fluorooctoxy)tetradecane?
1-ethoxy-14-(8-fluorooctoxy)tetradecane has a molecular weight of 388.65 g/mol, XLogP of 8.03, 24 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-14-(8-fluorooctoxy)tetradecane is sourced from PubChem (CID 139714700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).