1,1-difluoroprop-1-en-2-yl(triethoxy)silane

C9H18F2O3Si — CID 21044536

IUPAC1,1-difluoroprop-1-en-2-yl(triethoxy)silane
SMILESCCO[Si](OCC)(OCC)C(C)=C(F)F
InChIInChI=1S/C9H18F2O3Si/c1-5-12-15(13-6-2,14-7-3)8(4)9(10)11/h5-7H2,1-4H3
InChIKeyDPPLSWAPJSXMGH-UHFFFAOYSA-N
MW240.32 g/mol
LogP2.74
Rot. Bonds7

About 1,1-difluoroprop-1-en-2-yl(triethoxy)silane

1,1-difluoroprop-1-en-2-yl(triethoxy)silane (PubChem CID 21044536) has the molecular formula C9H18F2O3Si and a molecular weight of 240.32 g/mol. Its IUPAC name is 1,1-difluoroprop-1-en-2-yl(triethoxy)silane.

Molecular Properties

Compound Name1,1-difluoroprop-1-en-2-yl(triethoxy)silane
PubChem CID21044536
Molecular FormulaC9H18F2O3Si
Molecular Weight240.32 g/mol
Exact Mass240.10
IUPAC Name1,1-difluoroprop-1-en-2-yl(triethoxy)silane
SMILESCCO[Si](OCC)(OCC)C(C)=C(F)F
InChIInChI=1S/C9H18F2O3Si/c1-5-12-15(13-6-2,14-7-3)8(4)9(10)11/h5-7H2,1-4H3
InChIKeyDPPLSWAPJSXMGH-UHFFFAOYSA-N
XLogP2.74
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.32
LogP ≤ 52.74
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 1,1-difluoroprop-1-en-2-yl(triethoxy)silane?
The IUPAC name of 1,1-difluoroprop-1-en-2-yl(triethoxy)silane (CID 21044536) is 1,1-difluoroprop-1-en-2-yl(triethoxy)silane.
What is the SMILES notation for 1,1-difluoroprop-1-en-2-yl(triethoxy)silane?
The canonical SMILES for 1,1-difluoroprop-1-en-2-yl(triethoxy)silane is CCO[Si](OCC)(OCC)C(C)=C(F)F.
What is the InChIKey of 1,1-difluoroprop-1-en-2-yl(triethoxy)silane?
The InChIKey is DPPLSWAPJSXMGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18F2O3Si/c1-5-12-15(13-6-2,14-7-3)8(4)9(10)11/h5-7H2,1-4H3.
What are the key properties of 1,1-difluoroprop-1-en-2-yl(triethoxy)silane?
1,1-difluoroprop-1-en-2-yl(triethoxy)silane has a molecular weight of 240.32 g/mol, XLogP of 2.74, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoroprop-1-en-2-yl(triethoxy)silane is sourced from PubChem (CID 21044536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).