chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane

C5H8ClF5Si — CID 23264280

IUPACchloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane
SMILESC[Si](C)(Cl)C(C(F)F)C(F)(F)F
InChIInChI=1S/C5H8ClF5Si/c1-12(2,6)3(4(7)8)5(9,10)11/h3-4H,1-2H3
InChIKeyXQTZSRSCQFFWSQ-UHFFFAOYSA-N
MW226.65 g/mol
LogP3.63
Rot. Bonds2

About chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane

chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane (PubChem CID 23264280) has the molecular formula C5H8ClF5Si and a molecular weight of 226.65 g/mol. Its IUPAC name is chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane.

Molecular Properties

Compound Namechloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane
PubChem CID23264280
Molecular FormulaC5H8ClF5Si
Molecular Weight226.65 g/mol
Exact Mass226.00
IUPAC Namechloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane
SMILESC[Si](C)(Cl)C(C(F)F)C(F)(F)F
InChIInChI=1S/C5H8ClF5Si/c1-12(2,6)3(4(7)8)5(9,10)11/h3-4H,1-2H3
InChIKeyXQTZSRSCQFFWSQ-UHFFFAOYSA-N
XLogP3.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.65
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane?
The IUPAC name of chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane (CID 23264280) is chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane.
What is the SMILES notation for chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane?
The canonical SMILES for chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane is C[Si](C)(Cl)C(C(F)F)C(F)(F)F.
What is the InChIKey of chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane?
The InChIKey is XQTZSRSCQFFWSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8ClF5Si/c1-12(2,6)3(4(7)8)5(9,10)11/h3-4H,1-2H3.
What are the key properties of chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane?
chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane has a molecular weight of 226.65 g/mol, XLogP of 3.63, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-dimethyl-(1,1,1,3,3-pentafluoropropan-2-yl)silane is sourced from PubChem (CID 23264280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).