2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide

C16H35BF3O5Si- — CID 170899743

IUPAC2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide
SMILESCC(C)(C)[Si](C)(C)OCCOCCOCCOCCOCC[B-](F)(F)F
InChIInChI=1S/C16H35BF3O5Si/c1-16(2,3)26(4,5)25-15-14-24-13-12-23-11-10-22-9-8-21-7-6-17(18,19)20/h6-15H2,1-5H3/q-1
InChIKeyBCFVEYZOOYDTCU-UHFFFAOYSA-N
MW403.34 g/mol
LogP3.92
Rot. Bonds16

About 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide

2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide (PubChem CID 170899743) has the molecular formula C16H35BF3O5Si- and a molecular weight of 403.34 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide.

Molecular Properties

Compound Name2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide
PubChem CID170899743
Molecular FormulaC16H35BF3O5Si-
Molecular Weight403.34 g/mol
Exact Mass403.23
IUPAC Name2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide
SMILESCC(C)(C)[Si](C)(C)OCCOCCOCCOCCOCC[B-](F)(F)F
InChIInChI=1S/C16H35BF3O5Si/c1-16(2,3)26(4,5)25-15-14-24-13-12-23-11-10-22-9-8-21-7-6-17(18,19)20/h6-15H2,1-5H3/q-1
InChIKeyBCFVEYZOOYDTCU-UHFFFAOYSA-N
XLogP3.92
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds16
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.34
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

tert-Butyl-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]dimethylsilane
CID 91694124
tert-Butyl-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]dimethylsilane
CID 91694125
2-[2-[2-[Tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethyl-trifluoroboranuide
CID 168434784
2-[2-[2-[2-[Tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide
CID 170897303
2-[2-[Tert-butyl(dimethyl)silyl]oxyethoxy]ethyl-trifluoroboranuide
CID 170899433
18-Fluoro-2,2,3,3-tetramethyl-4,7,10,13,16-pentaoxa-3-silaoctadecane
CID 178210677
21-Fluoro-2,2,3,3-tetramethyl-4,7,10,13,16,19-hexaoxa-3-silahenicosane
CID 178210678
24-Fluoro-2,2,3,3-tetramethyl-4,7,10,13,16,19,22-heptaoxa-3-silatetracosane
CID 178210679
Tert-butyl-dimethyl-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]silane
CID 174138831
Tert-butyl-dimethyl-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]silane
CID 157470012
Tert-butyl-dimethyl-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]silane
CID 160121916
Potassium 1,1,1-trifluoro-11,11,12,12-tetramethyl-4,7,10-trioxa-11-sila-1-boratridecan-1-uide
CID 168434783

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide?
The IUPAC name of 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide (CID 170899743) is 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide.
What is the SMILES notation for 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide?
The canonical SMILES for 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide is CC(C)(C)[Si](C)(C)OCCOCCOCCOCCOCC[B-](F)(F)F.
What is the InChIKey of 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide?
The InChIKey is BCFVEYZOOYDTCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35BF3O5Si/c1-16(2,3)26(4,5)25-15-14-24-13-12-23-11-10-22-9-8-21-7-6-17(18,19)20/h6-15H2,1-5H3/q-1.
What are the key properties of 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide?
2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide has a molecular weight of 403.34 g/mol, XLogP of 3.92, 16 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide is sourced from PubChem (CID 170899743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).