1-(2-ethoxyethoxy)-1,3-difluoropropane

C7H14F2O2 — CID 57226963

IUPAC1-(2-ethoxyethoxy)-1,3-difluoropropane
SMILESCCOCCOC(F)CCF
InChIInChI=1S/C7H14F2O2/c1-2-10-5-6-11-7(9)3-4-8/h7H,2-6H2,1H3
InChIKeyCZRXFQLUNJPXTH-UHFFFAOYSA-N
MW168.18 g/mol
LogP1.69
Rot. Bonds7

About 1-(2-ethoxyethoxy)-1,3-difluoropropane

1-(2-ethoxyethoxy)-1,3-difluoropropane (PubChem CID 57226963) has the molecular formula C7H14F2O2 and a molecular weight of 168.18 g/mol. Its IUPAC name is 1-(2-ethoxyethoxy)-1,3-difluoropropane.

Molecular Properties

Compound Name1-(2-ethoxyethoxy)-1,3-difluoropropane
PubChem CID57226963
Molecular FormulaC7H14F2O2
Molecular Weight168.18 g/mol
Exact Mass168.10
IUPAC Name1-(2-ethoxyethoxy)-1,3-difluoropropane
SMILESCCOCCOC(F)CCF
InChIInChI=1S/C7H14F2O2/c1-2-10-5-6-11-7(9)3-4-8/h7H,2-6H2,1H3
InChIKeyCZRXFQLUNJPXTH-UHFFFAOYSA-N
XLogP1.69
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 ≤ 51.69
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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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethoxy)-1,3-difluoropropane?
The IUPAC name of 1-(2-ethoxyethoxy)-1,3-difluoropropane (CID 57226963) is 1-(2-ethoxyethoxy)-1,3-difluoropropane.
What is the SMILES notation for 1-(2-ethoxyethoxy)-1,3-difluoropropane?
The canonical SMILES for 1-(2-ethoxyethoxy)-1,3-difluoropropane is CCOCCOC(F)CCF.
What is the InChIKey of 1-(2-ethoxyethoxy)-1,3-difluoropropane?
The InChIKey is CZRXFQLUNJPXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F2O2/c1-2-10-5-6-11-7(9)3-4-8/h7H,2-6H2,1H3.
What are the key properties of 1-(2-ethoxyethoxy)-1,3-difluoropropane?
1-(2-ethoxyethoxy)-1,3-difluoropropane has a molecular weight of 168.18 g/mol, XLogP of 1.69, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethoxy)-1,3-difluoropropane is sourced from PubChem (CID 57226963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).