(2,4-difluorophenyl)-trimethoxysilane

C9H12F2O3Si — CID 90170978

IUPAC(2,4-difluorophenyl)-trimethoxysilane
SMILESCO[Si](OC)(OC)c1ccc(F)cc1F
InChIInChI=1S/C9H12F2O3Si/c1-12-15(13-2,14-3)9-5-4-7(10)6-8(9)11/h4-6H,1-3H3
InChIKeyPSVOFUULWLWXGT-UHFFFAOYSA-N
MW234.27 g/mol
LogP1.05
Rot. Bonds4

About (2,4-difluorophenyl)-trimethoxysilane

(2,4-difluorophenyl)-trimethoxysilane (PubChem CID 90170978) has the molecular formula C9H12F2O3Si and a molecular weight of 234.27 g/mol. Its IUPAC name is (2,4-difluorophenyl)-trimethoxysilane.

Molecular Properties

Compound Name(2,4-difluorophenyl)-trimethoxysilane
PubChem CID90170978
Molecular FormulaC9H12F2O3Si
Molecular Weight234.27 g/mol
Exact Mass234.05
IUPAC Name(2,4-difluorophenyl)-trimethoxysilane
SMILESCO[Si](OC)(OC)c1ccc(F)cc1F
InChIInChI=1S/C9H12F2O3Si/c1-12-15(13-2,14-3)9-5-4-7(10)6-8(9)11/h4-6H,1-3H3
InChIKeyPSVOFUULWLWXGT-UHFFFAOYSA-N
XLogP1.05
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.27
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2,4-difluorophenyl)-trimethoxysilane?
The IUPAC name of (2,4-difluorophenyl)-trimethoxysilane (CID 90170978) is (2,4-difluorophenyl)-trimethoxysilane.
What is the SMILES notation for (2,4-difluorophenyl)-trimethoxysilane?
The canonical SMILES for (2,4-difluorophenyl)-trimethoxysilane is CO[Si](OC)(OC)c1ccc(F)cc1F.
What is the InChIKey of (2,4-difluorophenyl)-trimethoxysilane?
The InChIKey is PSVOFUULWLWXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2O3Si/c1-12-15(13-2,14-3)9-5-4-7(10)6-8(9)11/h4-6H,1-3H3.
What are the key properties of (2,4-difluorophenyl)-trimethoxysilane?
(2,4-difluorophenyl)-trimethoxysilane has a molecular weight of 234.27 g/mol, XLogP of 1.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-difluorophenyl)-trimethoxysilane is sourced from PubChem (CID 90170978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).