1,2-bis(2-fluoroethoxy)propane

C7H14F2O2 — CID 175717319

IUPAC1,2-bis(2-fluoroethoxy)propane
SMILESCC(COCCF)OCCF
InChIInChI=1S/C7H14F2O2/c1-7(11-5-3-9)6-10-4-2-8/h7H,2-6H2,1H3
InChIKeyWCTOYUZOEMULSV-UHFFFAOYSA-N
MW168.18 g/mol
LogP1.35
Rot. Bonds7

About 1,2-bis(2-fluoroethoxy)propane

1,2-bis(2-fluoroethoxy)propane (PubChem CID 175717319) has the molecular formula C7H14F2O2 and a molecular weight of 168.18 g/mol. Its IUPAC name is 1,2-bis(2-fluoroethoxy)propane.

Molecular Properties

Compound Name1,2-bis(2-fluoroethoxy)propane
PubChem CID175717319
Molecular FormulaC7H14F2O2
Molecular Weight168.18 g/mol
Exact Mass168.10
IUPAC Name1,2-bis(2-fluoroethoxy)propane
SMILESCC(COCCF)OCCF
InChIInChI=1S/C7H14F2O2/c1-7(11-5-3-9)6-10-4-2-8/h7H,2-6H2,1H3
InChIKeyWCTOYUZOEMULSV-UHFFFAOYSA-N
XLogP1.35
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.18
LogP ≤ 51.35
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

2-(2-fluoroethoxy)-1-methoxypropane
CID 175717335
2-propoxy-1-[2-(2-propoxypropoxy)ethoxy]propane
CID 87065837
1,2-bis(2-chloroethoxy)propane
CID 154131394
ethane;1-[2-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]ethoxy]-2-methylpropane
CID 171646714
2-(1-propoxypropan-2-yloxy)ethanol
CID 59676189
2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane
CID 58121620
2-[2-[2-(2-aminopropoxy)propoxy]ethoxy]propan-1-amine
CID 58898571
1-(2-hexoxypropoxy)hexane
CID 71353992
1-(2-propoxypropoxy)pentane
CID 22002926
1-(1-propoxypropan-2-yloxy)pentane
CID 154093458
1-(2-fluoroethoxy)butan-2-ol
CID 58952834
2-(1-octoxypropan-2-yloxy)ethanol
CID 59000352

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(2-fluoroethoxy)propane?
The IUPAC name of 1,2-bis(2-fluoroethoxy)propane (CID 175717319) is 1,2-bis(2-fluoroethoxy)propane.
What is the SMILES notation for 1,2-bis(2-fluoroethoxy)propane?
The canonical SMILES for 1,2-bis(2-fluoroethoxy)propane is CC(COCCF)OCCF.
What is the InChIKey of 1,2-bis(2-fluoroethoxy)propane?
The InChIKey is WCTOYUZOEMULSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F2O2/c1-7(11-5-3-9)6-10-4-2-8/h7H,2-6H2,1H3.
What are the key properties of 1,2-bis(2-fluoroethoxy)propane?
1,2-bis(2-fluoroethoxy)propane has a molecular weight of 168.18 g/mol, XLogP of 1.35, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(2-fluoroethoxy)propane is sourced from PubChem (CID 175717319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).