1-fluorobutane;fluoroethane;methane

C10H27F3 — CID 157360418

IUPAC1-fluorobutane;fluoroethane;methane
SMILESC.C.CCCCF.CCF.CCF
InChIInChI=1S/C4H9F.2C2H5F.2CH4/c1-2-3-4-5;2*1-2-3;;/h2-4H2,1H3;2*2H2,1H3;2*1H4
InChIKeyBIOPAEJTKBCOOH-UHFFFAOYSA-N
MW204.32 g/mol
LogP4.98
Rot. Bonds2

About 1-fluorobutane;fluoroethane;methane

1-fluorobutane;fluoroethane;methane (PubChem CID 157360418) has the molecular formula C10H27F3 and a molecular weight of 204.32 g/mol. Its IUPAC name is 1-fluorobutane;fluoroethane;methane.

Molecular Properties

Compound Name1-fluorobutane;fluoroethane;methane
PubChem CID157360418
Molecular FormulaC10H27F3
Molecular Weight204.32 g/mol
Exact Mass204.21
IUPAC Name1-fluorobutane;fluoroethane;methane
SMILESC.C.CCCCF.CCF.CCF
InChIInChI=1S/C4H9F.2C2H5F.2CH4/c1-2-3-4-5;2*1-2-3;;/h2-4H2,1H3;2*2H2,1H3;2*1H4
InChIKeyBIOPAEJTKBCOOH-UHFFFAOYSA-N
XLogP4.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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1-fluoropentane;tetrafluoromethane
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CID 59847724
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1-fluorobutane;propane;(4R,5S)-tricyclo[3.1.0.02,4]hex-1-ene
CID 144514392
methane;pentane;propane
CID 143342797
bis(hexacosane);methane
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Frequently Asked Questions

What is the IUPAC name of 1-fluorobutane;fluoroethane;methane?
The IUPAC name of 1-fluorobutane;fluoroethane;methane (CID 157360418) is 1-fluorobutane;fluoroethane;methane.
What is the SMILES notation for 1-fluorobutane;fluoroethane;methane?
The canonical SMILES for 1-fluorobutane;fluoroethane;methane is C.C.CCCCF.CCF.CCF.
What is the InChIKey of 1-fluorobutane;fluoroethane;methane?
The InChIKey is BIOPAEJTKBCOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9F.2C2H5F.2CH4/c1-2-3-4-5;2*1-2-3;;/h2-4H2,1H3;2*2H2,1H3;2*1H4.
What are the key properties of 1-fluorobutane;fluoroethane;methane?
1-fluorobutane;fluoroethane;methane has a molecular weight of 204.32 g/mol, XLogP of 4.98, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluorobutane;fluoroethane;methane is sourced from PubChem (CID 157360418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).