tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane

C12H23F3OSi — CID 157280353

IUPACtert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane
SMILESCC(C)(C)[Si](C)(C)OC1C[C@H](C([C@H](C1)F)F)F
InChIInChI=1S/C12H23F3OSi/c1-12(2,3)17(4,5)16-8-6-9(13)11(15)10(14)7-8/h8-11H,6-7H2,1-5H3/t8?,9-,10+,11?
InChIKeyAZPAKHVSTVTHCV-GGWWSXTCSA-N
MW268.39 g/mol
LogP—
Rot. Bonds3

About tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane

tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane (PubChem CID 157280353) has the molecular formula C12H23F3OSi and a molecular weight of 268.39 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane
PubChem CID157280353
Molecular FormulaC12H23F3OSi
Molecular Weight268.39 g/mol
Exact Mass268.15
IUPAC Nametert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane
SMILESCC(C)(C)[Si](C)(C)OC1C[C@H](C([C@H](C1)F)F)F
InChIInChI=1S/C12H23F3OSi/c1-12(2,3)17(4,5)16-8-6-9(13)11(15)10(14)7-8/h8-11H,6-7H2,1-5H3/t8?,9-,10+,11?
InChIKeyAZPAKHVSTVTHCV-GGWWSXTCSA-N
XLogP—
TPSA9.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity253

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane (CID 157280353) is tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane is CC(C)(C)[Si](C)(C)OC1C[C@H](C([C@H](C1)F)F)F.
What is the InChIKey of tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane?
The InChIKey is AZPAKHVSTVTHCV-GGWWSXTCSA-N. The full InChI is InChI=1S/C12H23F3OSi/c1-12(2,3)17(4,5)16-8-6-9(13)11(15)10(14)7-8/h8-11H,6-7H2,1-5H3/t8?,9-,10+,11?.
What are the key properties of tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane?
tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane has a molecular weight of 268.39 g/mol, XLogP of not available, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(3R,5S)-3,4,5-trifluorocyclohexyl]oxysilane is sourced from PubChem (CID 157280353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).