triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane

C12H21F7O3Si — CID 152557275

IUPACtriethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane
SMILESCCO[Si](CCCC(F)(C(F)(F)F)C(F)(F)F)(OCC)OCC
InChIInChI=1S/C12H21F7O3Si/c1-4-20-23(21-5-2,22-6-3)9-7-8-10(13,11(14,15)16)12(17,18)19/h4-9H2,1-3H3
InChIKeyYOTGRJXWHMJFOI-UHFFFAOYSA-N
MW374.37 g/mol
LogP4.65
Rot. Bonds10

About triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane

triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane (PubChem CID 152557275) has the molecular formula C12H21F7O3Si and a molecular weight of 374.37 g/mol. Its IUPAC name is triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane.

Molecular Properties

Compound Nametriethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane
PubChem CID152557275
Molecular FormulaC12H21F7O3Si
Molecular Weight374.37 g/mol
Exact Mass374.11
IUPAC Nametriethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane
SMILESCCO[Si](CCCC(F)(C(F)(F)F)C(F)(F)F)(OCC)OCC
InChIInChI=1S/C12H21F7O3Si/c1-4-20-23(21-5-2,22-6-3)9-7-8-10(13,11(14,15)16)12(17,18)19/h4-9H2,1-3H3
InChIKeyYOTGRJXWHMJFOI-UHFFFAOYSA-N
XLogP4.65
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.37
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Triethoxy[5,5,6,6,7,7,7-heptafluoro-4,4-bis(trifluoromethyl)heptyl]silane
CID 14794618
Silane, dimethyl(2,2,3,3,4,4,5,5-octafluoropentyloxy)isohexyloxy-
CID 91698245
Triethoxy(1,1,2,2,3,3,4-heptafluoropentyl)silane
CID 17912895
Triethoxy(1,2,2,3,4,5,5-heptafluoropentyl)silane
CID 19078826
Triethoxy(3,3,4,4,4-pentafluorobutyl)silane
CID 19963837
Triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane
CID 19963852
Triethoxy(1,2,2,3,3,4,5,6,6-nonafluorohexyl)silane
CID 20066489
Tripropoxy(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)silane
CID 20513043
Silane, triethoxy(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-
CID 22600765
Triethoxy(4,4,5,5,6,6,6-heptafluorohexyl)silane
CID 22600767
Chloro-[1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)pentan-2-yl]-diethoxysilane
CID 23523519
[1,1,1,3,3,4,4,5,5,5-Decafluoro-2-(trifluoromethyl)pentan-2-yl]-triethoxysilane
CID 23523579

Frequently Asked Questions

What is the IUPAC name of triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane?
The IUPAC name of triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane (CID 152557275) is triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane.
What is the SMILES notation for triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane?
The canonical SMILES for triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane is CCO[Si](CCCC(F)(C(F)(F)F)C(F)(F)F)(OCC)OCC.
What is the InChIKey of triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane?
The InChIKey is YOTGRJXWHMJFOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F7O3Si/c1-4-20-23(21-5-2,22-6-3)9-7-8-10(13,11(14,15)16)12(17,18)19/h4-9H2,1-3H3.
What are the key properties of triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane?
triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane has a molecular weight of 374.37 g/mol, XLogP of 4.65, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentyl]silane is sourced from PubChem (CID 152557275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).