2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane

C10H19F3OSi — CID 19796036

IUPAC2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane
SMILESCC(F)C(F)(F)[Si]1(C)CCCC(C)(C)O1
InChIInChI=1S/C10H19F3OSi/c1-8(11)10(12,13)15(4)7-5-6-9(2,3)14-15/h8H,5-7H2,1-4H3
InChIKeyILIBSSDERBQADE-UHFFFAOYSA-N
MW240.34 g/mol
LogP3.68
Rot. Bonds2

About 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane

2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane (PubChem CID 19796036) has the molecular formula C10H19F3OSi and a molecular weight of 240.34 g/mol. Its IUPAC name is 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane.

Molecular Properties

Compound Name2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane
PubChem CID19796036
Molecular FormulaC10H19F3OSi
Molecular Weight240.34 g/mol
Exact Mass240.12
IUPAC Name2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane
SMILESCC(F)C(F)(F)[Si]1(C)CCCC(C)(C)O1
InChIInChI=1S/C10H19F3OSi/c1-8(11)10(12,13)15(4)7-5-6-9(2,3)14-15/h8H,5-7H2,1-4H3
InChIKeyILIBSSDERBQADE-UHFFFAOYSA-N
XLogP3.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.34
LogP ≤ 53.68
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

CID 66651735
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CID 67069006
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CID 67069031
CID 67069031
CID 67706264
CID 67706264
CID 67882370
CID 67882370
CID 69887081
CID 69887081
CID 70171527
CID 70171527
CID 87728885
CID 87728885
CID 87787785
CID 87787785
CID 89814271
CID 89814271
CID 147446809
CID 147446809
CID 157790427
CID 157790427

Frequently Asked Questions

What is the IUPAC name of 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane?
The IUPAC name of 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane (CID 19796036) is 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane.
What is the SMILES notation for 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane?
The canonical SMILES for 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane is CC(F)C(F)(F)[Si]1(C)CCCC(C)(C)O1.
What is the InChIKey of 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane?
The InChIKey is ILIBSSDERBQADE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3OSi/c1-8(11)10(12,13)15(4)7-5-6-9(2,3)14-15/h8H,5-7H2,1-4H3.
What are the key properties of 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane?
2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane has a molecular weight of 240.34 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,6-trimethyl-2-(1,1,2-trifluoropropyl)oxasilinane is sourced from PubChem (CID 19796036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).