tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane

C12H25F3O3Si — CID 87076727

IUPACtri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane
SMILESCC(C)O[Si](OC(C)C)(OC(C)C)C(F)(F)C(C)F
InChIInChI=1S/C12H25F3O3Si/c1-8(2)16-19(17-9(3)4,18-10(5)6)12(14,15)11(7)13/h8-11H,1-7H3
InChIKeySIIIYKAEPZUSBO-UHFFFAOYSA-N
MW302.41 g/mol
LogP3.73
Rot. Bonds8

About tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane

tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane (PubChem CID 87076727) has the molecular formula C12H25F3O3Si and a molecular weight of 302.41 g/mol. Its IUPAC name is tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane.

Molecular Properties

Compound Nametri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane
PubChem CID87076727
Molecular FormulaC12H25F3O3Si
Molecular Weight302.41 g/mol
Exact Mass302.15
IUPAC Nametri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane
SMILESCC(C)O[Si](OC(C)C)(OC(C)C)C(F)(F)C(C)F
InChIInChI=1S/C12H25F3O3Si/c1-8(2)16-19(17-9(3)4,18-10(5)6)12(14,15)11(7)13/h8-11H,1-7H3
InChIKeySIIIYKAEPZUSBO-UHFFFAOYSA-N
XLogP3.73
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.41
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Triethoxy(3,3,3-trifluoropropyl)silane
CID 13222391
Diethoxy(methyl)(3,3,3-trifluoropropyl)silane
CID 14007317
Triethyl 1,1,1,3,3,3-hexafluoropropan-2-yl silicate
CID 11056596
Diethoxy-methyl-(1,1,1-trifluoropropan-2-yl)silane
CID 13222402
Triethoxy(1,1,2,2,3,3,4-heptafluoropentyl)silane
CID 17912895
Triethoxy(2,2,2-trifluoroethyl)silane
CID 18188373
Tripropoxy(3,3,3-trifluoropropyl)silane
CID 18519534
(3,3-Difluoropropyl)triethoxysilane
CID 19963833
Triethoxy(3,3,4,4,4-pentafluorobutyl)silane
CID 19963837
Tripropoxy(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)silane
CID 20513043
1,1-Difluoroprop-1-en-2-yl(triethoxy)silane
CID 21044536
Triethoxy(2,3,3-trifluoropropyl)silane
CID 21896245

Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane?
The IUPAC name of tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane (CID 87076727) is tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane.
What is the SMILES notation for tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane?
The canonical SMILES for tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane is CC(C)O[Si](OC(C)C)(OC(C)C)C(F)(F)C(C)F.
What is the InChIKey of tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane?
The InChIKey is SIIIYKAEPZUSBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25F3O3Si/c1-8(2)16-19(17-9(3)4,18-10(5)6)12(14,15)11(7)13/h8-11H,1-7H3.
What are the key properties of tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane?
tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane has a molecular weight of 302.41 g/mol, XLogP of 3.73, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yloxy)-(1,1,2-trifluoropropyl)silane is sourced from PubChem (CID 87076727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).