2,2-difluoroethyl(trimethoxy)silane

C5H12F2O3Si — CID 87720096

IUPAC2,2-difluoroethyl(trimethoxy)silane
SMILESCO[Si](CC(F)F)(OC)OC
InChIInChI=1S/C5H12F2O3Si/c1-8-11(9-2,10-3)4-5(6)7/h5H,4H2,1-3H3
InChIKeyYVYXEGYIBDUAGX-UHFFFAOYSA-N
MW186.23 g/mol
LogP1.13
Rot. Bonds5

About 2,2-difluoroethyl(trimethoxy)silane

2,2-difluoroethyl(trimethoxy)silane (PubChem CID 87720096) has the molecular formula C5H12F2O3Si and a molecular weight of 186.23 g/mol. Its IUPAC name is 2,2-difluoroethyl(trimethoxy)silane.

Molecular Properties

Compound Name2,2-difluoroethyl(trimethoxy)silane
PubChem CID87720096
Molecular FormulaC5H12F2O3Si
Molecular Weight186.23 g/mol
Exact Mass186.05
IUPAC Name2,2-difluoroethyl(trimethoxy)silane
SMILESCO[Si](CC(F)F)(OC)OC
InChIInChI=1S/C5H12F2O3Si/c1-8-11(9-2,10-3)4-5(6)7/h5H,4H2,1-3H3
InChIKeyYVYXEGYIBDUAGX-UHFFFAOYSA-N
XLogP1.13
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.23
LogP ≤ 51.13
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

Silane, dimethoxymethyl(3,3,3-trifluoropropyl)-
CID 67751
3,3,3-Trifluoropropyl-trimethoxysilane
CID 67933
Methoxy(dimethyl)(3,3,3-trifluoropropyl)silane
CID 22497830
Trifluoro-propyl-trimethoxysilane
CID 87858807
Dimethyl-methyltrifluoropropyl siloxane
CID 129721233
Methyltrifluoropropylsiloxanediol
CID 129867356
Trifluoropropylmethoxysilane
CID 19790037
Dimethoxy-methyl-(1,1,1-trifluoropropan-2-yl)silane
CID 13222401
Dimethoxy-methyl-(2,3,3-trifluoropropyl)silane
CID 17767618
Trimethoxy(1,1,1-trifluorobutan-2-yl)silane
CID 18417922
Trimethoxy(1,2,3,4,4-pentafluorobutyl)silane
CID 18504294
2-Fluoroethyl(trimethoxy)silane
CID 18626697

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoroethyl(trimethoxy)silane?
The IUPAC name of 2,2-difluoroethyl(trimethoxy)silane (CID 87720096) is 2,2-difluoroethyl(trimethoxy)silane.
What is the SMILES notation for 2,2-difluoroethyl(trimethoxy)silane?
The canonical SMILES for 2,2-difluoroethyl(trimethoxy)silane is CO[Si](CC(F)F)(OC)OC.
What is the InChIKey of 2,2-difluoroethyl(trimethoxy)silane?
The InChIKey is YVYXEGYIBDUAGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12F2O3Si/c1-8-11(9-2,10-3)4-5(6)7/h5H,4H2,1-3H3.
What are the key properties of 2,2-difluoroethyl(trimethoxy)silane?
2,2-difluoroethyl(trimethoxy)silane has a molecular weight of 186.23 g/mol, XLogP of 1.13, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoroethyl(trimethoxy)silane is sourced from PubChem (CID 87720096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).