dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium

C8H19F3P2+2 — CID 20802276

IUPACdimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium
SMILESC[P+](C)(C)CC[P+](C)(C)C(F)(F)F
InChIInChI=1S/C8H19F3P2/c1-12(2,3)6-7-13(4,5)8(9,10)11/h6-7H2,1-5H3/q+2
InChIKeyQRUDFMKRSBIEEG-UHFFFAOYSA-N
MW234.18 g/mol
LogP3.69
Rot. Bonds3

About dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium

dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium (PubChem CID 20802276) has the molecular formula C8H19F3P2+2 and a molecular weight of 234.18 g/mol. Its IUPAC name is dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium.

Molecular Properties

Compound Namedimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium
PubChem CID20802276
Molecular FormulaC8H19F3P2+2
Molecular Weight234.18 g/mol
Exact Mass234.09
IUPAC Namedimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium
SMILESC[P+](C)(C)CC[P+](C)(C)C(F)(F)F
InChIInChI=1S/C8H19F3P2/c1-12(2,3)6-7-13(4,5)8(9,10)11/h6-7H2,1-5H3/q+2
InChIKeyQRUDFMKRSBIEEG-UHFFFAOYSA-N
XLogP3.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.18
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-[Bis(trifluoromethyl)phosphanyl]butan-2-yl-bis(trifluoromethyl)phosphane
CID 20063726
Tributyl(2,2,2-trifluoroethyl)phosphanium
CID 21062497
Tributyl(trifluoromethyl)phosphanium
CID 21062500
(2-Dimethylphosphanyl-1,1-difluoroethyl)-dimethylphosphane
CID 21732289
3-[Bis(trifluoromethyl)phosphanyl]butan-2-yl-bis(trifluoromethyl)phosphane
CID 21732291
[Diethylphosphanyl(fluoro)methyl]-diethylphosphane
CID 57177496
1-[Bis(1,1,2,2,2-pentafluoroethyl)phosphanyl]ethyl-bis(1,1,2,2,2-pentafluoroethyl)phosphane
CID 87459273
Tris(1-fluorobutyl)phosphane
CID 87612447
Dibutyl(2,2,2-trifluoroethyl)phosphane
CID 89202861
Dibutyl(difluoromethyl)phosphane
CID 89202863
Dibutyl(trifluoromethyl)phosphane
CID 89202864
3,3,4,4,4-Pentafluorobutyl-dipropyl-(3,3,3-trifluoropropyl)phosphanium
CID 89503935

Frequently Asked Questions

What is the IUPAC name of dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium?
The IUPAC name of dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium (CID 20802276) is dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium.
What is the SMILES notation for dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium?
The canonical SMILES for dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium is C[P+](C)(C)CC[P+](C)(C)C(F)(F)F.
What is the InChIKey of dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium?
The InChIKey is QRUDFMKRSBIEEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19F3P2/c1-12(2,3)6-7-13(4,5)8(9,10)11/h6-7H2,1-5H3/q+2.
What are the key properties of dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium?
dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium has a molecular weight of 234.18 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(trifluoromethyl)-(2-trimethylphosphaniumylethyl)phosphanium is sourced from PubChem (CID 20802276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).