butane;pentahydrofluoride

C4H15F5 — CID 158827877

IUPACbutane;pentahydrofluoride
SMILESCCCC.F.F.F.F.F
InChIInChI=1S/C4H10.5FH/c1-3-4-2;;;;;/h3-4H2,1-2H3;5*1H
InChIKeyKXEALMYKGZOFKK-UHFFFAOYSA-N
MW158.15 g/mol
LogP2.57
Rot. Bonds1

About butane;pentahydrofluoride

butane;pentahydrofluoride (PubChem CID 158827877) has the molecular formula C4H15F5 and a molecular weight of 158.15 g/mol. Its IUPAC name is butane;pentahydrofluoride.

Molecular Properties

Compound Namebutane;pentahydrofluoride
PubChem CID158827877
Molecular FormulaC4H15F5
Molecular Weight158.15 g/mol
Exact Mass158.11
IUPAC Namebutane;pentahydrofluoride
SMILESCCCC.F.F.F.F.F
InChIInChI=1S/C4H10.5FH/c1-3-4-2;;;;;/h3-4H2,1-2H3;5*1H
InChIKeyKXEALMYKGZOFKK-UHFFFAOYSA-N
XLogP2.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.15
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of butane;pentahydrofluoride?
The IUPAC name of butane;pentahydrofluoride (CID 158827877) is butane;pentahydrofluoride.
What is the SMILES notation for butane;pentahydrofluoride?
The canonical SMILES for butane;pentahydrofluoride is CCCC.F.F.F.F.F.
What is the InChIKey of butane;pentahydrofluoride?
The InChIKey is KXEALMYKGZOFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10.5FH/c1-3-4-2;;;;;/h3-4H2,1-2H3;5*1H.
What are the key properties of butane;pentahydrofluoride?
butane;pentahydrofluoride has a molecular weight of 158.15 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butane;pentahydrofluoride is sourced from PubChem (CID 158827877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).