methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane

C18H35F3O4Si-2 — CID 59974844

IUPACmethoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane
SMILESCO[Si]([O-])([O-])CCCCCCCCCCCCCCCOCC(F)(F)F
InChIInChI=1S/C18H35F3O4Si/c1-24-26(22,23)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-25-17-18(19,20)21/h2-17H2,1H3/q-2
InChIKeyKQYOJCFHOADJGJ-UHFFFAOYSA-N
MW400.55 g/mol
LogP3.94
Rot. Bonds18

About methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane

methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane (PubChem CID 59974844) has the molecular formula C18H35F3O4Si-2 and a molecular weight of 400.55 g/mol. Its IUPAC name is methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane.

Molecular Properties

Compound Namemethoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane
PubChem CID59974844
Molecular FormulaC18H35F3O4Si-2
Molecular Weight400.55 g/mol
Exact Mass400.23
IUPAC Namemethoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane
SMILESCO[Si]([O-])([O-])CCCCCCCCCCCCCCCOCC(F)(F)F
InChIInChI=1S/C18H35F3O4Si/c1-24-26(22,23)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-25-17-18(19,20)21/h2-17H2,1H3/q-2
InChIKeyKQYOJCFHOADJGJ-UHFFFAOYSA-N
XLogP3.94
TPSA64.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds18
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.55
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(3-((8-Methoxyoctyl)oxy)propyl)-1,1,1,3,5,5,5-heptamethyltrisiloxane
CID 60196421
Triethoxy[3-[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)oxy]propyl]silane
CID 18466366
12-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]-12-[3-[(perfluoroheptyl)methoxy]propyl]-2,5,8,11,13,16,19,22-octaoxa-12-silatricosane
CID 162396566
9-[2-(2-Methoxyethoxy)ethoxy]-9-[3-[(perfluoroheptyl)methoxy]propyl]-2,5,8,10,13,16-hexaoxa-9-silaheptadecane
CID 162396630
Trimethoxy-{3-[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)-oxy]-propyl}-silane
CID 19733902
Dodecafluoroheptylpropyltrimethoxysilane
CID 122197693
Methoxy-{3-[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)-oxy]-propyl}-silane
CID 129819305
Trimethoxy-[2-[3-(17,17,17-trifluoroheptadecyl)oxiran-2-yl]ethyl]silane
CID 17986845
Trimethoxy-[1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctoxy)propyl]silane
CID 19737008
15-[Diethoxy(methyl)silyl]pentadecyl 2,2,2-trifluoroacetate
CID 19770314
Trimethoxy-[15-(1,2,2-trifluoroethoxy)pentadecyl]silane
CID 19770320
Hydroxy-dimethyl-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)propyl]silane
CID 19771209

Frequently Asked Questions

What is the IUPAC name of methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane?
The IUPAC name of methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane (CID 59974844) is methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane.
What is the SMILES notation for methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane?
The canonical SMILES for methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane is CO[Si]([O-])([O-])CCCCCCCCCCCCCCCOCC(F)(F)F.
What is the InChIKey of methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane?
The InChIKey is KQYOJCFHOADJGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35F3O4Si/c1-24-26(22,23)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-25-17-18(19,20)21/h2-17H2,1H3/q-2.
What are the key properties of methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane?
methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane has a molecular weight of 400.55 g/mol, XLogP of 3.94, 18 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane is sourced from PubChem (CID 59974844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).