(4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane

C11H12F4O3Si — CID 22924815

IUPAC(4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane
SMILESC=Cc1c(F)c(F)c([Si](OC)(OC)OC)c(F)c1F
InChIInChI=1S/C11H12F4O3Si/c1-5-6-7(12)9(14)11(10(15)8(6)13)19(16-2,17-3)18-4/h5H,1H2,2-4H3
InChIKeyBLNUWYASRJTEMW-UHFFFAOYSA-N
MW296.29 g/mol
LogP1.97
Rot. Bonds5

About (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane

(4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane (PubChem CID 22924815) has the molecular formula C11H12F4O3Si and a molecular weight of 296.29 g/mol. Its IUPAC name is (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane.

Molecular Properties

Compound Name(4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane
PubChem CID22924815
Molecular FormulaC11H12F4O3Si
Molecular Weight296.29 g/mol
Exact Mass296.05
IUPAC Name(4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane
SMILESC=Cc1c(F)c(F)c([Si](OC)(OC)OC)c(F)c1F
InChIInChI=1S/C11H12F4O3Si/c1-5-6-7(12)9(14)11(10(15)8(6)13)19(16-2,17-3)18-4/h5H,1H2,2-4H3
InChIKeyBLNUWYASRJTEMW-UHFFFAOYSA-N
XLogP1.97
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.29
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane?
The IUPAC name of (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane (CID 22924815) is (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane.
What is the SMILES notation for (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane?
The canonical SMILES for (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane is C=Cc1c(F)c(F)c([Si](OC)(OC)OC)c(F)c1F.
What is the InChIKey of (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane?
The InChIKey is BLNUWYASRJTEMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F4O3Si/c1-5-6-7(12)9(14)11(10(15)8(6)13)19(16-2,17-3)18-4/h5H,1H2,2-4H3.
What are the key properties of (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane?
(4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane has a molecular weight of 296.29 g/mol, XLogP of 1.97, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethenyl-2,3,5,6-tetrafluorophenyl)-trimethoxysilane is sourced from PubChem (CID 22924815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).