2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane

C11H23F3O2Si — CID 131724268

IUPAC2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane
SMILESCC(C)[SiH](C(C)C)C(C)C.O=C(O)C(F)(F)F
InChIInChI=1S/C9H22Si.C2HF3O2/c1-7(2)10(8(3)4)9(5)6;3-2(4,5)1(6)7/h7-10H,1-6H3;(H,6,7)
InChIKeyOYUJQLYQYZDQAG-UHFFFAOYSA-N
MW272.38 g/mol
LogP4.08
Rot. Bonds3

About 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane

2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane (PubChem CID 131724268) has the molecular formula C11H23F3O2Si and a molecular weight of 272.38 g/mol. Its IUPAC name is 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane.

Molecular Properties

Compound Name2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane
PubChem CID131724268
Molecular FormulaC11H23F3O2Si
Molecular Weight272.38 g/mol
Exact Mass272.14
IUPAC Name2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane
SMILESCC(C)[SiH](C(C)C)C(C)C.O=C(O)C(F)(F)F
InChIInChI=1S/C9H22Si.C2HF3O2/c1-7(2)10(8(3)4)9(5)6;3-2(4,5)1(6)7/h7-10H,1-6H3;(H,6,7)
InChIKeyOYUJQLYQYZDQAG-UHFFFAOYSA-N
XLogP4.08
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.38
LogP ≤ 54.08
H-Bond Donors ≤ 51
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 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane?
The IUPAC name of 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane (CID 131724268) is 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane.
What is the SMILES notation for 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane?
The canonical SMILES for 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane is CC(C)[SiH](C(C)C)C(C)C.O=C(O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane?
The InChIKey is OYUJQLYQYZDQAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22Si.C2HF3O2/c1-7(2)10(8(3)4)9(5)6;3-2(4,5)1(6)7/h7-10H,1-6H3;(H,6,7).
What are the key properties of 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane?
2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane has a molecular weight of 272.38 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoroacetic acid;tri(propan-2-yl)silane is sourced from PubChem (CID 131724268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).