dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane

C16H26F6O2Si — CID 87192739

IUPACdimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane
SMILESC[Si](C)(OC1(C(F)(F)F)CCCCC1)OC1(C(F)(F)F)CCCCC1
InChIInChI=1S/C16H26F6O2Si/c1-25(2,23-13(15(17,18)19)9-5-3-6-10-13)24-14(16(20,21)22)11-7-4-8-12-14/h3-12H2,1-2H3
InChIKeyPXCJCYUTJBVSRB-UHFFFAOYSA-N
MW392.46 g/mol
LogP6.25
Rot. Bonds4

About dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane

dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane (PubChem CID 87192739) has the molecular formula C16H26F6O2Si and a molecular weight of 392.46 g/mol. Its IUPAC name is dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane.

Molecular Properties

Compound Namedimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane
PubChem CID87192739
Molecular FormulaC16H26F6O2Si
Molecular Weight392.46 g/mol
Exact Mass392.16
IUPAC Namedimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane
SMILESC[Si](C)(OC1(C(F)(F)F)CCCCC1)OC1(C(F)(F)F)CCCCC1
InChIInChI=1S/C16H26F6O2Si/c1-25(2,23-13(15(17,18)19)9-5-3-6-10-13)24-14(16(20,21)22)11-7-4-8-12-14/h3-12H2,1-2H3
InChIKeyPXCJCYUTJBVSRB-UHFFFAOYSA-N
XLogP6.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.46
LogP ≤ 56.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane 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 dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane?
The IUPAC name of dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane (CID 87192739) is dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane.
What is the SMILES notation for dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane?
The canonical SMILES for dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane is C[Si](C)(OC1(C(F)(F)F)CCCCC1)OC1(C(F)(F)F)CCCCC1.
What is the InChIKey of dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane?
The InChIKey is PXCJCYUTJBVSRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26F6O2Si/c1-25(2,23-13(15(17,18)19)9-5-3-6-10-13)24-14(16(20,21)22)11-7-4-8-12-14/h3-12H2,1-2H3.
What are the key properties of dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane?
dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane has a molecular weight of 392.46 g/mol, XLogP of 6.25, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis[[1-(trifluoromethyl)cyclohexyl]oxy]silane is sourced from PubChem (CID 87192739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).