ethyl(1,1,2,2,2-pentafluoroethyl)phosphane

C4H6F5P — CID 22638324

IUPACethyl(1,1,2,2,2-pentafluoroethyl)phosphane
SMILESCCPC(F)(F)C(F)(F)F
InChIInChI=1S/C4H6F5P/c1-2-10-4(8,9)3(5,6)7/h10H,2H2,1H3
InChIKeyAPVJCHKZIDLNJL-UHFFFAOYSA-N
MW180.06 g/mol
LogP2.84
Rot. Bonds2

About ethyl(1,1,2,2,2-pentafluoroethyl)phosphane

ethyl(1,1,2,2,2-pentafluoroethyl)phosphane (PubChem CID 22638324) has the molecular formula C4H6F5P and a molecular weight of 180.06 g/mol. Its IUPAC name is ethyl(1,1,2,2,2-pentafluoroethyl)phosphane.

Molecular Properties

Compound Nameethyl(1,1,2,2,2-pentafluoroethyl)phosphane
PubChem CID22638324
Molecular FormulaC4H6F5P
Molecular Weight180.06 g/mol
Exact Mass180.01
IUPAC Nameethyl(1,1,2,2,2-pentafluoroethyl)phosphane
SMILESCCPC(F)(F)C(F)(F)F
InChIInChI=1S/C4H6F5P/c1-2-10-4(8,9)3(5,6)7/h10H,2H2,1H3
InChIKeyAPVJCHKZIDLNJL-UHFFFAOYSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.06
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethyl(1,1,2,2,2-pentafluoroethyl)phosphane?
The IUPAC name of ethyl(1,1,2,2,2-pentafluoroethyl)phosphane (CID 22638324) is ethyl(1,1,2,2,2-pentafluoroethyl)phosphane.
What is the SMILES notation for ethyl(1,1,2,2,2-pentafluoroethyl)phosphane?
The canonical SMILES for ethyl(1,1,2,2,2-pentafluoroethyl)phosphane is CCPC(F)(F)C(F)(F)F.
What is the InChIKey of ethyl(1,1,2,2,2-pentafluoroethyl)phosphane?
The InChIKey is APVJCHKZIDLNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6F5P/c1-2-10-4(8,9)3(5,6)7/h10H,2H2,1H3.
What are the key properties of ethyl(1,1,2,2,2-pentafluoroethyl)phosphane?
ethyl(1,1,2,2,2-pentafluoroethyl)phosphane has a molecular weight of 180.06 g/mol, XLogP of 2.84, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl(1,1,2,2,2-pentafluoroethyl)phosphane is sourced from PubChem (CID 22638324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).