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

C14H31BF3O4Si- — CID 170897303

IUPAC2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide
SMILESCC(C)(C)[Si](C)(C)OCCOCCOCCOCC[B-](F)(F)F
InChIInChI=1S/C14H31BF3O4Si/c1-14(2,3)23(4,5)22-13-12-21-11-10-20-9-8-19-7-6-15(16,17)18/h6-13H2,1-5H3/q-1
InChIKeyLBMBOICTOZKPEE-UHFFFAOYSA-N
MW359.29 g/mol
LogP3.91
Rot. Bonds13

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

2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide (PubChem CID 170897303) has the molecular formula C14H31BF3O4Si- and a molecular weight of 359.29 g/mol. Its IUPAC name is 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide.

Molecular Properties

Compound Name2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide
PubChem CID170897303
Molecular FormulaC14H31BF3O4Si-
Molecular Weight359.29 g/mol
Exact Mass359.20
IUPAC Name2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide
SMILESCC(C)(C)[Si](C)(C)OCCOCCOCCOCC[B-](F)(F)F
InChIInChI=1S/C14H31BF3O4Si/c1-14(2,3)23(4,5)22-13-12-21-11-10-20-9-8-19-7-6-15(16,17)18/h6-13H2,1-5H3/q-1
InChIKeyLBMBOICTOZKPEE-UHFFFAOYSA-N
XLogP3.91
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.29
LogP ≤ 53.91
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

tert-Butyl-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]dimethylsilane
CID 91694118
2-[2-[2-[Tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethyl-trifluoroboranuide
CID 168434784
2-[2-[Tert-butyl(dimethyl)silyl]oxyethoxy]ethyl-trifluoroboranuide
CID 170899433
2-[2-[2-[2-[2-[Tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide
CID 170899743
15-Fluoro-2,2,3,3-tetramethyl-4,7,10,13-tetraoxa-3-silapentadecane
CID 178210676
Potassium 1,1,1-trifluoro-11,11,12,12-tetramethyl-4,7,10-trioxa-11-sila-1-boratridecan-1-uide
CID 168434783
Potassium 1,1,1-trifluoro-14,14,15,15-tetramethyl-4,7,10,13-tetraoxa-14-sila-1-borahexadecan-1-uide
CID 170897302
Potassium 1,1,1-trifluoro-8,8,9,9-tetramethyl-4,7-dioxa-8-sila-1-boradecan-1-uide
CID 170899432
Potassium 1,1,1-trifluoro-17,17,18,18-tetramethyl-4,7,10,13,16-pentaoxa-17-sila-1-boranonadecan-1-uide
CID 170899742

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide?
The IUPAC name of 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide (CID 170897303) is 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide.
What is the SMILES notation for 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide?
The canonical SMILES for 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide is CC(C)(C)[Si](C)(C)OCCOCCOCCOCC[B-](F)(F)F.
What is the InChIKey of 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide?
The InChIKey is LBMBOICTOZKPEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31BF3O4Si/c1-14(2,3)23(4,5)22-13-12-21-11-10-20-9-8-19-7-6-15(16,17)18/h6-13H2,1-5H3/q-1.
What are the key properties of 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide?
2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide has a molecular weight of 359.29 g/mol, XLogP of 3.91, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide is sourced from PubChem (CID 170897303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).