trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane

C19H9F33OSi — CID 102003082

IUPACtrimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane
SMILESC[Si](C)(C)OC(C(F)(F)F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(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)F
InChIInChI=1S/C19H9F33OSi/c1-54(2,3)53-4(17(44,45)46,6(22,23)8(26,27)10(30,31)13(36,37)15(40,41)18(47,48)49)5(20,21)7(24,25)9(28,29)11(32,33)12(34,35)14(38,39)16(42,43)19(50,51)52/h1-3H3
InChIKeyZZOSUZGZWKEZEN-UHFFFAOYSA-N
MW908.30 g/mol
LogP11.89
Rot. Bonds14

About trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane

trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane (PubChem CID 102003082) has the molecular formula C19H9F33OSi and a molecular weight of 908.30 g/mol. Its IUPAC name is trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane
PubChem CID102003082
Molecular FormulaC19H9F33OSi
Molecular Weight908.30 g/mol
Exact Mass907.99
IUPAC Nametrimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane
SMILESC[Si](C)(C)OC(C(F)(F)F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(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)F
InChIInChI=1S/C19H9F33OSi/c1-54(2,3)53-4(17(44,45)46,6(22,23)8(26,27)10(30,31)13(36,37)15(40,41)18(47,48)49)5(20,21)7(24,25)9(28,29)11(32,33)12(34,35)14(38,39)16(42,43)19(50,51)52/h1-3H3
InChIKeyZZOSUZGZWKEZEN-UHFFFAOYSA-N
XLogP11.89
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500908.30
LogP ≤ 511.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane with MolForge

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Related Compounds

(3-Ethyl-4,4-difluorooctan-3-yl)oxy-trimethylsilane
CID 172550767
(3,3,4,4,5,5,6,6,7,7,8,8,9,9,12,12,12-Heptadecafluoro-2-methyldodecan-2-yl)oxy-dimethoxy-methylsilane
CID 173608411
6-(1,2,2,3,3,4,4,5,5,6,6,7,7,8,9,10,10-Heptadecafluorodecyl)-2,2,6-trimethyloxasilinane
CID 174989694
6-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Henicosafluorodecyl)-2,2,6-trimethyloxasilinane
CID 175180201
6-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Heptadecafluorooctyl)-2,2,6-trimethyloxasilinane
CID 175469731
CID 22495113
CID 22495113

Frequently Asked Questions

What is the IUPAC name of trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane?
The IUPAC name of trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane (CID 102003082) is trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane.
What is the SMILES notation for trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane?
The canonical SMILES for trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane is C[Si](C)(C)OC(C(F)(F)F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(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)F.
What is the InChIKey of trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane?
The InChIKey is ZZOSUZGZWKEZEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H9F33OSi/c1-54(2,3)53-4(17(44,45)46,6(22,23)8(26,27)10(30,31)13(36,37)15(40,41)18(47,48)49)5(20,21)7(24,25)9(28,29)11(32,33)12(34,35)14(38,39)16(42,43)19(50,51)52/h1-3H3.
What are the key properties of trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane?
trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane has a molecular weight of 908.30 g/mol, XLogP of 11.89, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1,1,1,2,2,3,3,4,4,5,5,6,6,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-triacontafluoro-7-(trifluoromethyl)pentadecan-7-yl]oxysilane is sourced from PubChem (CID 102003082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).