bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane

C16H30F4OSi2 — CID 18443966

IUPACbis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane
SMILESC[Si](C)(C)O[Si](C)(C1CCCCC1(F)F)C1CCCCC1(F)F
InChIInChI=1S/C16H30F4OSi2/c1-22(2,3)21-23(4,13-9-5-7-11-15(13,17)18)14-10-6-8-12-16(14,19)20/h13-14H,5-12H2,1-4H3
InChIKeyYHPSXHLVYMBQED-UHFFFAOYSA-N
MW370.58 g/mol
LogP6.57
Rot. Bonds4

About bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane

bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane (PubChem CID 18443966) has the molecular formula C16H30F4OSi2 and a molecular weight of 370.58 g/mol. Its IUPAC name is bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane.

Molecular Properties

Compound Namebis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane
PubChem CID18443966
Molecular FormulaC16H30F4OSi2
Molecular Weight370.58 g/mol
Exact Mass370.18
IUPAC Namebis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane
SMILESC[Si](C)(C)O[Si](C)(C1CCCCC1(F)F)C1CCCCC1(F)F
InChIInChI=1S/C16H30F4OSi2/c1-22(2,3)21-23(4,13-9-5-7-11-15(13,17)18)14-10-6-8-12-16(14,19)20/h13-14H,5-12H2,1-4H3
InChIKeyYHPSXHLVYMBQED-UHFFFAOYSA-N
XLogP6.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.58
LogP ≤ 56.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane?
The IUPAC name of bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane (CID 18443966) is bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane.
What is the SMILES notation for bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane?
The canonical SMILES for bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane is C[Si](C)(C)O[Si](C)(C1CCCCC1(F)F)C1CCCCC1(F)F.
What is the InChIKey of bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane?
The InChIKey is YHPSXHLVYMBQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30F4OSi2/c1-22(2,3)21-23(4,13-9-5-7-11-15(13,17)18)14-10-6-8-12-16(14,19)20/h13-14H,5-12H2,1-4H3.
What are the key properties of bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane?
bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane has a molecular weight of 370.58 g/mol, XLogP of 6.57, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,2-difluorocyclohexyl)-methyl-trimethylsilyloxysilane is sourced from PubChem (CID 18443966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).