2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane

C10H19F3OSi — CID 67882370

IUPAC2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane
SMILESCC1(CC(F)C(F)F)CCC[Si](C)(C)O1
InChIInChI=1S/C10H19F3OSi/c1-10(7-8(11)9(12)13)5-4-6-15(2,3)14-10/h8-9H,4-7H2,1-3H3
InChIKeyGROQMQLHCHGNLD-UHFFFAOYSA-N
MW240.34 g/mol
LogP3.75
Rot. Bonds3

About 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane

2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane (PubChem CID 67882370) has the molecular formula C10H19F3OSi and a molecular weight of 240.34 g/mol. Its IUPAC name is 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane.

Molecular Properties

Compound Name2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane
PubChem CID67882370
Molecular FormulaC10H19F3OSi
Molecular Weight240.34 g/mol
Exact Mass240.12
IUPAC Name2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane
SMILESCC1(CC(F)C(F)F)CCC[Si](C)(C)O1
InChIInChI=1S/C10H19F3OSi/c1-10(7-8(11)9(12)13)5-4-6-15(2,3)14-10/h8-9H,4-7H2,1-3H3
InChIKeyGROQMQLHCHGNLD-UHFFFAOYSA-N
XLogP3.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.34
LogP ≤ 53.75
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 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane?
The IUPAC name of 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane (CID 67882370) is 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane.
What is the SMILES notation for 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane?
The canonical SMILES for 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane is CC1(CC(F)C(F)F)CCC[Si](C)(C)O1.
What is the InChIKey of 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane?
The InChIKey is GROQMQLHCHGNLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3OSi/c1-10(7-8(11)9(12)13)5-4-6-15(2,3)14-10/h8-9H,4-7H2,1-3H3.
What are the key properties of 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane?
2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane has a molecular weight of 240.34 g/mol, XLogP of 3.75, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6-trimethyl-6-(2,3,3-trifluoropropyl)oxasilinane is sourced from PubChem (CID 67882370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).