2-fluoro-1-(2-fluorobutoxy)butane

C8H16F2O — CID 118625531

IUPAC2-fluoro-1-(2-fluorobutoxy)butane
SMILESCCC(F)COCC(F)CC
InChIInChI=1S/C8H16F2O/c1-3-7(9)5-11-6-8(10)4-2/h7-8H,3-6H2,1-2H3
InChIKeyAVUXLJSLGLWKTD-UHFFFAOYSA-N
MW166.21 g/mol
LogP2.50
Rot. Bonds6

About 2-fluoro-1-(2-fluorobutoxy)butane

2-fluoro-1-(2-fluorobutoxy)butane (PubChem CID 118625531) has the molecular formula C8H16F2O and a molecular weight of 166.21 g/mol. Its IUPAC name is 2-fluoro-1-(2-fluorobutoxy)butane.

Molecular Properties

Compound Name2-fluoro-1-(2-fluorobutoxy)butane
PubChem CID118625531
Molecular FormulaC8H16F2O
Molecular Weight166.21 g/mol
Exact Mass166.12
IUPAC Name2-fluoro-1-(2-fluorobutoxy)butane
SMILESCCC(F)COCC(F)CC
InChIInChI=1S/C8H16F2O/c1-3-7(9)5-11-6-8(10)4-2/h7-8H,3-6H2,1-2H3
InChIKeyAVUXLJSLGLWKTD-UHFFFAOYSA-N
XLogP2.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.21
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Butyl ether
CID 8909
Boron, trifluoro(1,1'-oxybis(butane))-, (T-4)-
CID 68970
Hydrofluoric acid, compd. with 1,1'-oxybis(butane) (2:1)
CID 173019
Ether, bis(4-fluorobutyl)
CID 11632
Butyl 2,2-difluoropropyl ether
CID 15062441
1-(2-Fluoropropoxy)butane
CID 15062442
1-Butoxy-2,2-difluorobutane
CID 15062445
1-Butoxy-2-fluorobutane
CID 15062446
gamma'-Difluorodibutyl ether
CID 129878663
4-Butoxy-1,1,1,2,4,4-hexafluorobutane
CID 91735803
Butyl(2,2,2-trifluoroethyl) ether
CID 14024098
1-(2-Fluoroethoxy)butane
CID 14625835

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-(2-fluorobutoxy)butane?
The IUPAC name of 2-fluoro-1-(2-fluorobutoxy)butane (CID 118625531) is 2-fluoro-1-(2-fluorobutoxy)butane.
What is the SMILES notation for 2-fluoro-1-(2-fluorobutoxy)butane?
The canonical SMILES for 2-fluoro-1-(2-fluorobutoxy)butane is CCC(F)COCC(F)CC.
What is the InChIKey of 2-fluoro-1-(2-fluorobutoxy)butane?
The InChIKey is AVUXLJSLGLWKTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F2O/c1-3-7(9)5-11-6-8(10)4-2/h7-8H,3-6H2,1-2H3.
What are the key properties of 2-fluoro-1-(2-fluorobutoxy)butane?
2-fluoro-1-(2-fluorobutoxy)butane has a molecular weight of 166.21 g/mol, XLogP of 2.50, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-(2-fluorobutoxy)butane is sourced from PubChem (CID 118625531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).