butane;fluoroethane;propane

C9H23F — CID 171505953

IUPACbutane;fluoroethane;propane
SMILESCCC.CCCC.CCF
InChIInChI=1S/C4H10.C3H8.C2H5F/c1-3-4-2;1-3-2;1-2-3/h3-4H2,1-2H3;3H2,1-2H3;2H2,1H3
InChIKeyGGSOGXVKHGKGIS-UHFFFAOYSA-N
MW150.28 g/mol
LogP4.20
Rot. Bonds1

About butane;fluoroethane;propane

butane;fluoroethane;propane (PubChem CID 171505953) has the molecular formula C9H23F and a molecular weight of 150.28 g/mol. Its IUPAC name is butane;fluoroethane;propane.

Molecular Properties

Compound Namebutane;fluoroethane;propane
PubChem CID171505953
Molecular FormulaC9H23F
Molecular Weight150.28 g/mol
Exact Mass150.18
IUPAC Namebutane;fluoroethane;propane
SMILESCCC.CCCC.CCF
InChIInChI=1S/C4H10.C3H8.C2H5F/c1-3-4-2;1-3-2;1-2-3/h3-4H2,1-2H3;3H2,1-2H3;2H2,1H3
InChIKeyGGSOGXVKHGKGIS-UHFFFAOYSA-N
XLogP4.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.28
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

fluoroethane;trihydrochloride
CID 172790972
CID 173162991
CID 173162991
1-(18F)fluoropropane
CID 59847724
butane;methane
CID 161323740
butane;hydrazine
CID 161056989
butane;dihydroiodide
CID 173299742
butane;octahydrofluoride
CID 173254735
butane;methane
CID 169432073
butane;neodymium
CID 173047512
butane;dihydrochloride
CID 175321374
butane;manganese
CID 173124338
azane;butane
CID 18518846

Frequently Asked Questions

What is the IUPAC name of butane;fluoroethane;propane?
The IUPAC name of butane;fluoroethane;propane (CID 171505953) is butane;fluoroethane;propane.
What is the SMILES notation for butane;fluoroethane;propane?
The canonical SMILES for butane;fluoroethane;propane is CCC.CCCC.CCF.
What is the InChIKey of butane;fluoroethane;propane?
The InChIKey is GGSOGXVKHGKGIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10.C3H8.C2H5F/c1-3-4-2;1-3-2;1-2-3/h3-4H2,1-2H3;3H2,1-2H3;2H2,1H3.
What are the key properties of butane;fluoroethane;propane?
butane;fluoroethane;propane has a molecular weight of 150.28 g/mol, XLogP of 4.20, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butane;fluoroethane;propane is sourced from PubChem (CID 171505953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).