trifluoromethyl(undecyl)phosphane

C12H24F3P — CID 21096806

IUPACtrifluoromethyl(undecyl)phosphane
SMILESCCCCCCCCCCCPC(F)(F)F
InChIInChI=1S/C12H24F3P/c1-2-3-4-5-6-7-8-9-10-11-16-12(13,14)15/h16H,2-11H2,1H3
InChIKeyMVUYFEBUVWWZKD-UHFFFAOYSA-N
MW256.29 g/mol
LogP5.72
Rot. Bonds10

About trifluoromethyl(undecyl)phosphane

trifluoromethyl(undecyl)phosphane (PubChem CID 21096806) has the molecular formula C12H24F3P and a molecular weight of 256.29 g/mol. Its IUPAC name is trifluoromethyl(undecyl)phosphane.

Molecular Properties

Compound Nametrifluoromethyl(undecyl)phosphane
PubChem CID21096806
Molecular FormulaC12H24F3P
Molecular Weight256.29 g/mol
Exact Mass256.16
IUPAC Nametrifluoromethyl(undecyl)phosphane
SMILESCCCCCCCCCCCPC(F)(F)F
InChIInChI=1S/C12H24F3P/c1-2-3-4-5-6-7-8-9-10-11-16-12(13,14)15/h16H,2-11H2,1H3
InChIKeyMVUYFEBUVWWZKD-UHFFFAOYSA-N
XLogP5.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.29
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

propyl(trifluoromethyl)phosphane
CID 21096795
chloro(hexadecyl)phosphane
CID 141387037
1,1,1-trifluorohexadecane
CID 15685316
docosyl(docosylphosphanyl)phosphane
CID 21095052
octyl(pentylphosphanyl)phosphane
CID 21095189
decyl(undecyl)phosphane
CID 87830755
di(nonadecyl)phosphane
CID 87828565
dodecyl(octyl)phosphane
CID 87829037
di(nonyl)phosphane;hydrochloride
CID 175813490
methyl(tetradecyl)phosphane
CID 88708624
butyl(heptadecyl)phosphane
CID 146521828
triacontane
CID 12535

Frequently Asked Questions

What is the IUPAC name of trifluoromethyl(undecyl)phosphane?
The IUPAC name of trifluoromethyl(undecyl)phosphane (CID 21096806) is trifluoromethyl(undecyl)phosphane.
What is the SMILES notation for trifluoromethyl(undecyl)phosphane?
The canonical SMILES for trifluoromethyl(undecyl)phosphane is CCCCCCCCCCCPC(F)(F)F.
What is the InChIKey of trifluoromethyl(undecyl)phosphane?
The InChIKey is MVUYFEBUVWWZKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24F3P/c1-2-3-4-5-6-7-8-9-10-11-16-12(13,14)15/h16H,2-11H2,1H3.
What are the key properties of trifluoromethyl(undecyl)phosphane?
trifluoromethyl(undecyl)phosphane has a molecular weight of 256.29 g/mol, XLogP of 5.72, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoromethyl(undecyl)phosphane is sourced from PubChem (CID 21096806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).