(3-fluoro-4-propan-2-ylphenyl)-trimethylsilane

C12H19FSi — CID 59596566

IUPAC(3-fluoro-4-propan-2-ylphenyl)-trimethylsilane
SMILESCC(C)c1ccc([Si](C)(C)C)cc1F
InChIInChI=1S/C12H19FSi/c1-9(2)11-7-6-10(8-12(11)13)14(3,4)5/h6-9H,1-5H3
InChIKeyQJHTYDSJEUWEEW-UHFFFAOYSA-N
MW210.37 g/mol
LogP3.49
Rot. Bonds2

About (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane

(3-fluoro-4-propan-2-ylphenyl)-trimethylsilane (PubChem CID 59596566) has the molecular formula C12H19FSi and a molecular weight of 210.37 g/mol. Its IUPAC name is (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane.

Molecular Properties

Compound Name(3-fluoro-4-propan-2-ylphenyl)-trimethylsilane
PubChem CID59596566
Molecular FormulaC12H19FSi
Molecular Weight210.37 g/mol
Exact Mass210.12
IUPAC Name(3-fluoro-4-propan-2-ylphenyl)-trimethylsilane
SMILESCC(C)c1ccc([Si](C)(C)C)cc1F
InChIInChI=1S/C12H19FSi/c1-9(2)11-7-6-10(8-12(11)13)14(3,4)5/h6-9H,1-5H3
InChIKeyQJHTYDSJEUWEEW-UHFFFAOYSA-N
XLogP3.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.37
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane?
The IUPAC name of (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane (CID 59596566) is (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane.
What is the SMILES notation for (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane?
The canonical SMILES for (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane is CC(C)c1ccc([Si](C)(C)C)cc1F.
What is the InChIKey of (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane?
The InChIKey is QJHTYDSJEUWEEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19FSi/c1-9(2)11-7-6-10(8-12(11)13)14(3,4)5/h6-9H,1-5H3.
What are the key properties of (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane?
(3-fluoro-4-propan-2-ylphenyl)-trimethylsilane has a molecular weight of 210.37 g/mol, XLogP of 3.49, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-propan-2-ylphenyl)-trimethylsilane is sourced from PubChem (CID 59596566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).