trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane

C16H35F3OSi2 — CID 18718400

IUPACtrimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane
SMILESCC(CCC(F)(F)F)(CC(C)(C)O[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C16H35F3OSi2/c1-14(2,20-22(7,8)9)12-15(3,13-21(4,5)6)10-11-16(17,18)19/h10-13H2,1-9H3
InChIKeyWDQCMMNJLPEZGZ-UHFFFAOYSA-N
MW356.62 g/mol
LogP6.69
Rot. Bonds8

About trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane

trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane (PubChem CID 18718400) has the molecular formula C16H35F3OSi2 and a molecular weight of 356.62 g/mol. Its IUPAC name is trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane
PubChem CID18718400
Molecular FormulaC16H35F3OSi2
Molecular Weight356.62 g/mol
Exact Mass356.22
IUPAC Nametrimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane
SMILESCC(CCC(F)(F)F)(CC(C)(C)O[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C16H35F3OSi2/c1-14(2,20-22(7,8)9)12-15(3,13-21(4,5)6)10-11-16(17,18)19/h10-13H2,1-9H3
InChIKeyWDQCMMNJLPEZGZ-UHFFFAOYSA-N
XLogP6.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.62
LogP ≤ 56.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Trimethyl-(2,2,4-trimethyl-1-trimethylsilylheptan-4-yl)oxysilane
CID 18716500
Trimethyl-(2,2,4-trimethyl-4-trimethylsilyloxytetradecyl)silane
CID 23526536
Trimethyl-[2-methyl-2-(2-methyl-2-trimethylsilyloxypropyl)heptyl]silane
CID 53695035
Trimethyl-(2,4,6,6-tetramethyl-7-trimethylsilylheptan-2-yl)oxysilane;yttrium
CID 59040092
Trimethyl-(2,4,4,6,6-pentamethyl-7-trimethylsilylheptan-2-yl)oxysilane
CID 59943032
Methane;methyl-(2,4,4,6,6-pentamethyl-7-methylsilylheptan-2-yl)oxysilane
CID 160640345
Trimethyl-(2,4,6,6-tetramethyl-7-trimethylsilylheptan-2-yl)oxysilane
CID 23566338

Frequently Asked Questions

What is the IUPAC name of trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane?
The IUPAC name of trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane (CID 18718400) is trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane.
What is the SMILES notation for trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane?
The canonical SMILES for trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane is CC(CCC(F)(F)F)(CC(C)(C)O[Si](C)(C)C)C[Si](C)(C)C.
What is the InChIKey of trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane?
The InChIKey is WDQCMMNJLPEZGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35F3OSi2/c1-14(2,20-22(7,8)9)12-15(3,13-21(4,5)6)10-11-16(17,18)19/h10-13H2,1-9H3.
What are the key properties of trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane?
trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane has a molecular weight of 356.62 g/mol, XLogP of 6.69, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[7,7,7-trifluoro-2,4-dimethyl-4-(trimethylsilylmethyl)heptan-2-yl]oxysilane is sourced from PubChem (CID 18718400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).