(2,6-difluorophenyl)methyl-triethoxysilane

C13H20F2O3Si — CID 146004962

IUPAC(2,6-difluorophenyl)methyl-triethoxysilane
SMILESCCO[Si](Cc1c(F)cccc1F)(OCC)OCC
InChIInChI=1S/C13H20F2O3Si/c1-4-16-19(17-5-2,18-6-3)10-11-12(14)8-7-9-13(11)15/h7-9H,4-6,10H2,1-3H3
InChIKeyLFMGWFDGUVOYLV-UHFFFAOYSA-N
MW290.38 g/mol
LogP3.09
Rot. Bonds8

About (2,6-difluorophenyl)methyl-triethoxysilane

(2,6-difluorophenyl)methyl-triethoxysilane (PubChem CID 146004962) has the molecular formula C13H20F2O3Si and a molecular weight of 290.38 g/mol. Its IUPAC name is (2,6-difluorophenyl)methyl-triethoxysilane.

Molecular Properties

Compound Name(2,6-difluorophenyl)methyl-triethoxysilane
PubChem CID146004962
Molecular FormulaC13H20F2O3Si
Molecular Weight290.38 g/mol
Exact Mass290.11
IUPAC Name(2,6-difluorophenyl)methyl-triethoxysilane
SMILESCCO[Si](Cc1c(F)cccc1F)(OCC)OCC
InChIInChI=1S/C13H20F2O3Si/c1-4-16-19(17-5-2,18-6-3)10-11-12(14)8-7-9-13(11)15/h7-9H,4-6,10H2,1-3H3
InChIKeyLFMGWFDGUVOYLV-UHFFFAOYSA-N
XLogP3.09
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.38
LogP ≤ 53.09
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

(2-chloro-6-fluorophenyl)methyl-triethoxysilane
CID 146004919
triethoxy-[(2-fluorophenyl)methyl]silane
CID 146004998
triethoxy-[(2-methoxy-6-methylphenyl)methyl]silane
CID 59566744
triethoxy-(2-fluorophenyl)silane
CID 139239787
2-(triethoxysilylmethyl)benzenethiol
CID 141156182
(2,6-difluorophenyl)methyl hypochlorite
CID 70312638
triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane
CID 59566888
2-[(2,6-difluorophenyl)methyl]-1,3-difluorobenzene
CID 15013079
benzyl(triethoxy)silane;propan-2-ol
CID 172724025
triethoxy-[(1S)-1-(2-fluorophenyl)ethyl]silane
CID 10108079
(2,6-difluorophenyl)methanethiol;ethane
CID 178170499
1-(2,6-difluorophenyl)-3-ethoxypropan-2-one
CID 114931357

Frequently Asked Questions

What is the IUPAC name of (2,6-difluorophenyl)methyl-triethoxysilane?
The IUPAC name of (2,6-difluorophenyl)methyl-triethoxysilane (CID 146004962) is (2,6-difluorophenyl)methyl-triethoxysilane.
What is the SMILES notation for (2,6-difluorophenyl)methyl-triethoxysilane?
The canonical SMILES for (2,6-difluorophenyl)methyl-triethoxysilane is CCO[Si](Cc1c(F)cccc1F)(OCC)OCC.
What is the InChIKey of (2,6-difluorophenyl)methyl-triethoxysilane?
The InChIKey is LFMGWFDGUVOYLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F2O3Si/c1-4-16-19(17-5-2,18-6-3)10-11-12(14)8-7-9-13(11)15/h7-9H,4-6,10H2,1-3H3.
What are the key properties of (2,6-difluorophenyl)methyl-triethoxysilane?
(2,6-difluorophenyl)methyl-triethoxysilane has a molecular weight of 290.38 g/mol, XLogP of 3.09, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-difluorophenyl)methyl-triethoxysilane is sourced from PubChem (CID 146004962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).