(3,4-difluoropyrazol-1-yl)-trimethylsilane

C6H10F2N2Si — CID 175578305

IUPAC(3,4-difluoropyrazol-1-yl)-trimethylsilane
SMILESC[Si](C)(C)n1cc(F)c(F)n1
InChIInChI=1S/C6H10F2N2Si/c1-11(2,3)10-4-5(7)6(8)9-10/h4H,1-3H3
InChIKeyXTYCFHBSSIIWDM-UHFFFAOYSA-N
MW176.24 g/mol
LogP1.84
Rot. Bonds1

About (3,4-difluoropyrazol-1-yl)-trimethylsilane

(3,4-difluoropyrazol-1-yl)-trimethylsilane (PubChem CID 175578305) has the molecular formula C6H10F2N2Si and a molecular weight of 176.24 g/mol. Its IUPAC name is (3,4-difluoropyrazol-1-yl)-trimethylsilane.

Molecular Properties

Compound Name(3,4-difluoropyrazol-1-yl)-trimethylsilane
PubChem CID175578305
Molecular FormulaC6H10F2N2Si
Molecular Weight176.24 g/mol
Exact Mass176.06
IUPAC Name(3,4-difluoropyrazol-1-yl)-trimethylsilane
SMILESC[Si](C)(C)n1cc(F)c(F)n1
InChIInChI=1S/C6H10F2N2Si/c1-11(2,3)10-4-5(7)6(8)9-10/h4H,1-3H3
InChIKeyXTYCFHBSSIIWDM-UHFFFAOYSA-N
XLogP1.84
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.24
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (3,4-difluoropyrazol-1-yl)-trimethylsilane?
The IUPAC name of (3,4-difluoropyrazol-1-yl)-trimethylsilane (CID 175578305) is (3,4-difluoropyrazol-1-yl)-trimethylsilane.
What is the SMILES notation for (3,4-difluoropyrazol-1-yl)-trimethylsilane?
The canonical SMILES for (3,4-difluoropyrazol-1-yl)-trimethylsilane is C[Si](C)(C)n1cc(F)c(F)n1.
What is the InChIKey of (3,4-difluoropyrazol-1-yl)-trimethylsilane?
The InChIKey is XTYCFHBSSIIWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2N2Si/c1-11(2,3)10-4-5(7)6(8)9-10/h4H,1-3H3.
What are the key properties of (3,4-difluoropyrazol-1-yl)-trimethylsilane?
(3,4-difluoropyrazol-1-yl)-trimethylsilane has a molecular weight of 176.24 g/mol, XLogP of 1.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-difluoropyrazol-1-yl)-trimethylsilane is sourced from PubChem (CID 175578305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).