tert-butyl-(10-fluoroundecoxy)-dimethylsilane

C17H37FOSi — CID 72697078

IUPACtert-butyl-(10-fluoroundecoxy)-dimethylsilane
SMILESCC(F)CCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H37FOSi/c1-16(18)14-12-10-8-7-9-11-13-15-19-20(5,6)17(2,3)4/h16H,7-15H2,1-6H3
InChIKeyFTUYLJOTSZDPCQ-UHFFFAOYSA-N
MW304.57 g/mol
LogP6.49
Rot. Bonds11

About tert-butyl-(10-fluoroundecoxy)-dimethylsilane

tert-butyl-(10-fluoroundecoxy)-dimethylsilane (PubChem CID 72697078) has the molecular formula C17H37FOSi and a molecular weight of 304.57 g/mol. Its IUPAC name is tert-butyl-(10-fluoroundecoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(10-fluoroundecoxy)-dimethylsilane
PubChem CID72697078
Molecular FormulaC17H37FOSi
Molecular Weight304.57 g/mol
Exact Mass304.26
IUPAC Nametert-butyl-(10-fluoroundecoxy)-dimethylsilane
SMILESCC(F)CCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H37FOSi/c1-16(18)14-12-10-8-7-9-11-13-15-19-20(5,6)17(2,3)4/h16H,7-15H2,1-6H3
InChIKeyFTUYLJOTSZDPCQ-UHFFFAOYSA-N
XLogP6.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.57
LogP ≤ 56.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-(10-fluoroundecoxy)-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(10-fluoroundecoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(10-fluoroundecoxy)-dimethylsilane (CID 72697078) is tert-butyl-(10-fluoroundecoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(10-fluoroundecoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(10-fluoroundecoxy)-dimethylsilane is CC(F)CCCCCCCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-(10-fluoroundecoxy)-dimethylsilane?
The InChIKey is FTUYLJOTSZDPCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37FOSi/c1-16(18)14-12-10-8-7-9-11-13-15-19-20(5,6)17(2,3)4/h16H,7-15H2,1-6H3.
What are the key properties of tert-butyl-(10-fluoroundecoxy)-dimethylsilane?
tert-butyl-(10-fluoroundecoxy)-dimethylsilane has a molecular weight of 304.57 g/mol, XLogP of 6.49, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(10-fluoroundecoxy)-dimethylsilane is sourced from PubChem (CID 72697078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).