trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane

C11H21F3O4Si — CID 90185067

IUPACtrimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
SMILESCO[Si](OC)(OC)C1(CCC(F)(F)F)CCCCO1
InChIInChI=1S/C11H21F3O4Si/c1-15-19(16-2,17-3)10(6-4-5-9-18-10)7-8-11(12,13)14/h4-9H2,1-3H3
InChIKeyWJTHRIGHSOZGEU-UHFFFAOYSA-N
MW302.37 g/mol
LogP2.69
Rot. Bonds6

About trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane

trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane (PubChem CID 90185067) has the molecular formula C11H21F3O4Si and a molecular weight of 302.37 g/mol. Its IUPAC name is trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane.

Molecular Properties

Compound Nametrimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
PubChem CID90185067
Molecular FormulaC11H21F3O4Si
Molecular Weight302.37 g/mol
Exact Mass302.12
IUPAC Nametrimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
SMILESCO[Si](OC)(OC)C1(CCC(F)(F)F)CCCCO1
InChIInChI=1S/C11H21F3O4Si/c1-15-19(16-2,17-3)10(6-4-5-9-18-10)7-8-11(12,13)14/h4-9H2,1-3H3
InChIKeyWJTHRIGHSOZGEU-UHFFFAOYSA-N
XLogP2.69
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Triethoxy[3-[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)oxy]propyl]silane
CID 18466366
Trimethoxy-{3-[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)-oxy]-propyl}-silane
CID 19733902
[2-(4,4,4-Trifluorobutyl)oxan-2-yl]silane
CID 123561163
Methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 123561843
Trimethoxy-[1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctoxy)propyl]silane
CID 19737008
Trimethoxy-[15-(1,2,2-trifluoroethoxy)pentadecyl]silane
CID 19770320
Trimethoxy-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane
CID 21335547
Methoxy-dioxido-[15-(2,2,2-trifluoroethoxy)pentadecyl]silane
CID 59974844
Triethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 69483329
Trimethyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 69887080
Triethoxy{3-[(heptadecafluorooctyl)oxy]propyl}silane
CID 71410842
Trimethoxy-[15-(1,1,2-trifluoroethoxy)pentadecyl]silane
CID 87516168

Frequently Asked Questions

What is the IUPAC name of trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane?
The IUPAC name of trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane (CID 90185067) is trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane.
What is the SMILES notation for trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane?
The canonical SMILES for trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane is CO[Si](OC)(OC)C1(CCC(F)(F)F)CCCCO1.
What is the InChIKey of trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane?
The InChIKey is WJTHRIGHSOZGEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3O4Si/c1-15-19(16-2,17-3)10(6-4-5-9-18-10)7-8-11(12,13)14/h4-9H2,1-3H3.
What are the key properties of trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane?
trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane has a molecular weight of 302.37 g/mol, XLogP of 2.69, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane is sourced from PubChem (CID 90185067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).