trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane

C22H20F24I2Si2 — CID 54440945

IUPACtrimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane
SMILESC[Si](C)(C)C(I)=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C=C(I)[Si](C)(C)C
InChIInChI=1S/C22H20F24I2Si2/c1-49(2,3)9(47)7-11(23,24)13(27,28)15(31,32)17(35,36)19(39,40)21(43,44)22(45,46)20(41,42)18(37,38)16(33,34)14(29,30)12(25,26)8-10(48)50(4,5)6/h7-8H,1-6H3
InChIKeyWOAUFODNDYNDRY-UHFFFAOYSA-N
MW1050.33 g/mol
LogP13.00
Rot. Bonds15

About trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane

trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane (PubChem CID 54440945) has the molecular formula C22H20F24I2Si2 and a molecular weight of 1050.33 g/mol. Its IUPAC name is trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane.

Molecular Properties

Compound Nametrimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane
PubChem CID54440945
Molecular FormulaC22H20F24I2Si2
Molecular Weight1050.33 g/mol
Exact Mass1049.88
IUPAC Nametrimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane
SMILESC[Si](C)(C)C(I)=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C=C(I)[Si](C)(C)C
InChIInChI=1S/C22H20F24I2Si2/c1-49(2,3)9(47)7-11(23,24)13(27,28)15(31,32)17(35,36)19(39,40)21(43,44)22(45,46)20(41,42)18(37,38)16(33,34)14(29,30)12(25,26)8-10(48)50(4,5)6/h7-8H,1-6H3
InChIKeyWOAUFODNDYNDRY-UHFFFAOYSA-N
XLogP13.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds15
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001050.33
LogP ≤ 513.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane?
The IUPAC name of trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane (CID 54440945) is trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane.
What is the SMILES notation for trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane?
The canonical SMILES for trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane is C[Si](C)(C)C(I)=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C=C(I)[Si](C)(C)C.
What is the InChIKey of trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane?
The InChIKey is WOAUFODNDYNDRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F24I2Si2/c1-49(2,3)9(47)7-11(23,24)13(27,28)15(31,32)17(35,36)19(39,40)21(43,44)22(45,46)20(41,42)18(37,38)16(33,34)14(29,30)12(25,26)8-10(48)50(4,5)6/h7-8H,1-6H3.
What are the key properties of trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane?
trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane has a molecular weight of 1050.33 g/mol, XLogP of 13.00, 15 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14-tetracosafluoro-1,16-diiodo-16-trimethylsilylhexadeca-1,15-dienyl)silane is sourced from PubChem (CID 54440945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).