but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane

C8H15F3OSi — CID 14993009

IUPACbut-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane
SMILESC=CCC[Si](C)(C)OCC(F)(F)F
InChIInChI=1S/C8H15F3OSi/c1-4-5-6-13(2,3)12-7-8(9,10)11/h4H,1,5-7H2,2-3H3
InChIKeyLFRLCDYEAVKMNW-UHFFFAOYSA-N
MW212.29 g/mol
LogP3.35
Rot. Bonds5

About but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane

but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane (PubChem CID 14993009) has the molecular formula C8H15F3OSi and a molecular weight of 212.29 g/mol. Its IUPAC name is but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane.

Molecular Properties

Compound Namebut-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane
PubChem CID14993009
Molecular FormulaC8H15F3OSi
Molecular Weight212.29 g/mol
Exact Mass212.08
IUPAC Namebut-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane
SMILESC=CCC[Si](C)(C)OCC(F)(F)F
InChIInChI=1S/C8H15F3OSi/c1-4-5-6-13(2,3)12-7-8(9,10)11/h4H,1,5-7H2,2-3H3
InChIKeyLFRLCDYEAVKMNW-UHFFFAOYSA-N
XLogP3.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[(1E)-3-(trifluoromethyl)buta-1,3-dienoxy]silane
CID 15192351
Trimethyl(1,1,1-trifluorobut-3-en-2-yloxy)silane
CID 14438973
trimethoxy-[(E)-4,4,4-trifluorobut-1-enyl]silane
CID 60145302
Dimethyl-pent-4-enyl-(2,2,2-trifluoroethoxy)silane
CID 14993021
Methoxy-methyl-prop-2-enyl-(1,1,1-trifluoropropan-2-yloxy)silane
CID 57925296
Dimethoxy-prop-2-enyl-(3,3,3-trifluoropropyl)silane
CID 87785670
Dimethoxy-prop-2-enyl-(1,1,2-trifluoropropyl)silane
CID 88010971
Dimethoxy-prop-2-enyl-(2,3,3-trifluoropropyl)silane
CID 88010972
Triethoxy(1,1,2-trifluorohepta-1,6-dien-4-yl)silane
CID 140475116
Ethoxy-prop-1-enyl-propyl-(2,2,2-trifluoroethoxy)silane
CID 152611867
Diethoxy(5,5,5-trifluoropent-1-enyl)silane
CID 154091045
But-1-enoxy-dimethyl-(3,3,3-trifluoropropyl)silane
CID 161266892

Frequently Asked Questions

What is the IUPAC name of but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane?
The IUPAC name of but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane (CID 14993009) is but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane.
What is the SMILES notation for but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane?
The canonical SMILES for but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane is C=CCC[Si](C)(C)OCC(F)(F)F.
What is the InChIKey of but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane?
The InChIKey is LFRLCDYEAVKMNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3OSi/c1-4-5-6-13(2,3)12-7-8(9,10)11/h4H,1,5-7H2,2-3H3.
What are the key properties of but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane?
but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane has a molecular weight of 212.29 g/mol, XLogP of 3.35, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-enyl-dimethyl-(2,2,2-trifluoroethoxy)silane is sourced from PubChem (CID 14993009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).