tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane

C11H20F2OSi — CID 142635632

IUPACtert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC#CC(F)F
InChIInChI=1S/C11H20F2OSi/c1-11(2,3)15(4,5)14-9-7-6-8-10(12)13/h10H,7,9H2,1-5H3
InChIKeyMOAAZLIWOVPQLG-UHFFFAOYSA-N
MW234.36 g/mol
LogP3.67
Rot. Bonds3

About tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane

tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane (PubChem CID 142635632) has the molecular formula C11H20F2OSi and a molecular weight of 234.36 g/mol. Its IUPAC name is tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane
PubChem CID142635632
Molecular FormulaC11H20F2OSi
Molecular Weight234.36 g/mol
Exact Mass234.13
IUPAC Nametert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC#CC(F)F
InChIInChI=1S/C11H20F2OSi/c1-11(2,3)15(4,5)14-9-7-6-8-10(12)13/h10H,7,9H2,1-5H3
InChIKeyMOAAZLIWOVPQLG-UHFFFAOYSA-N
XLogP3.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 53.67
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane (CID 142635632) is tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane is CC(C)(C)[Si](C)(C)OCCC#CC(F)F.
What is the InChIKey of tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane?
The InChIKey is MOAAZLIWOVPQLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F2OSi/c1-11(2,3)15(4,5)14-9-7-6-8-10(12)13/h10H,7,9H2,1-5H3.
What are the key properties of tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane?
tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane has a molecular weight of 234.36 g/mol, XLogP of 3.67, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(5,5-difluoropent-3-ynoxy)-dimethylsilane is sourced from PubChem (CID 142635632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).