dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane

C16H31F3OSi2 — CID 18443985

IUPACdicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane
SMILESC[Si](O[Si](C)(C)C(F)(F)F)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C16H31F3OSi2/c1-21(2,16(17,18)19)20-22(3,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h14-15H,4-13H2,1-3H3
InChIKeyCIBAICVCPJLGSC-UHFFFAOYSA-N
MW352.59 g/mol
LogP6.55
Rot. Bonds4

About dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane

dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane (PubChem CID 18443985) has the molecular formula C16H31F3OSi2 and a molecular weight of 352.59 g/mol. Its IUPAC name is dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane.

Molecular Properties

Compound Namedicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane
PubChem CID18443985
Molecular FormulaC16H31F3OSi2
Molecular Weight352.59 g/mol
Exact Mass352.19
IUPAC Namedicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane
SMILESC[Si](O[Si](C)(C)C(F)(F)F)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C16H31F3OSi2/c1-21(2,16(17,18)19)20-22(3,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h14-15H,4-13H2,1-3H3
InChIKeyCIBAICVCPJLGSC-UHFFFAOYSA-N
XLogP6.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.59
LogP ≤ 56.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane
CID 18443966
Dicyclohexyl-(trifluoromethyl)-trimethylsilyloxysilane
CID 145785993
Cyclohexyl-(cyclohexyl-fluoro-methylsilyl)oxy-fluoro-methylsilane
CID 152178012

Frequently Asked Questions

What is the IUPAC name of dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane?
The IUPAC name of dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane (CID 18443985) is dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane.
What is the SMILES notation for dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane?
The canonical SMILES for dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane is C[Si](O[Si](C)(C)C(F)(F)F)(C1CCCCC1)C1CCCCC1.
What is the InChIKey of dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane?
The InChIKey is CIBAICVCPJLGSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31F3OSi2/c1-21(2,16(17,18)19)20-22(3,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h14-15H,4-13H2,1-3H3.
What are the key properties of dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane?
dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane has a molecular weight of 352.59 g/mol, XLogP of 6.55, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dicyclohexyl-[dimethyl(trifluoromethyl)silyl]oxy-methylsilane is sourced from PubChem (CID 18443985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).