9-trimethylsilyloxyfluorene-9-carbonitrile

C17H17NOSi — CID 10826550

IUPAC9-trimethylsilyloxyfluorene-9-carbonitrile
SMILESC[Si](C)(C)OC1(C#N)c2ccccc2-c2ccccc21
InChIInChI=1S/C17H17NOSi/c1-20(2,3)19-17(12-18)15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11H,1-3H3
InChIKeyMSAYCKNTHMUHBA-UHFFFAOYSA-N
MW279.42 g/mol
LogP4.29
Rot. Bonds2

About 9-trimethylsilyloxyfluorene-9-carbonitrile

9-trimethylsilyloxyfluorene-9-carbonitrile (PubChem CID 10826550) has the molecular formula C17H17NOSi and a molecular weight of 279.42 g/mol. Its IUPAC name is 9-trimethylsilyloxyfluorene-9-carbonitrile.

Molecular Properties

Compound Name9-trimethylsilyloxyfluorene-9-carbonitrile
PubChem CID10826550
Molecular FormulaC17H17NOSi
Molecular Weight279.42 g/mol
Exact Mass279.11
IUPAC Name9-trimethylsilyloxyfluorene-9-carbonitrile
SMILESC[Si](C)(C)OC1(C#N)c2ccccc2-c2ccccc21
InChIInChI=1S/C17H17NOSi/c1-20(2,3)19-17(12-18)15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11H,1-3H3
InChIKeyMSAYCKNTHMUHBA-UHFFFAOYSA-N
XLogP4.29
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.42
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 9-trimethylsilyloxyfluorene-9-carbonitrile?
The IUPAC name of 9-trimethylsilyloxyfluorene-9-carbonitrile (CID 10826550) is 9-trimethylsilyloxyfluorene-9-carbonitrile.
What is the SMILES notation for 9-trimethylsilyloxyfluorene-9-carbonitrile?
The canonical SMILES for 9-trimethylsilyloxyfluorene-9-carbonitrile is C[Si](C)(C)OC1(C#N)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-trimethylsilyloxyfluorene-9-carbonitrile?
The InChIKey is MSAYCKNTHMUHBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NOSi/c1-20(2,3)19-17(12-18)15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11H,1-3H3.
What are the key properties of 9-trimethylsilyloxyfluorene-9-carbonitrile?
9-trimethylsilyloxyfluorene-9-carbonitrile has a molecular weight of 279.42 g/mol, XLogP of 4.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-trimethylsilyloxyfluorene-9-carbonitrile is sourced from PubChem (CID 10826550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).