tert-butyl-(4-iodobutoxy)-dimethylsilane

C10H23IOSi — CID 4250746

IUPACtert-butyl-(4-iodobutoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCCCI
InChIInChI=1S/C10H23IOSi/c1-10(2,3)13(4,5)12-9-7-6-8-11/h6-9H2,1-5H3
InChIKeyINGJYKISFRSCQV-UHFFFAOYSA-N
MW314.28 g/mol
LogP4.22
Rot. Bonds5

About tert-butyl-(4-iodobutoxy)-dimethylsilane

tert-butyl-(4-iodobutoxy)-dimethylsilane (PubChem CID 4250746) has the molecular formula C10H23IOSi and a molecular weight of 314.28 g/mol. Its IUPAC name is tert-butyl-(4-iodobutoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(4-iodobutoxy)-dimethylsilane
PubChem CID4250746
Molecular FormulaC10H23IOSi
Molecular Weight314.28 g/mol
Exact Mass314.06
IUPAC Nametert-butyl-(4-iodobutoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCCCI
InChIInChI=1S/C10H23IOSi/c1-10(2,3)13(4,5)12-9-7-6-8-11/h6-9H2,1-5H3
InChIKeyINGJYKISFRSCQV-UHFFFAOYSA-N
XLogP4.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.28
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-Butyl(2-iodoethoxy)dimethylsilane
CID 11129873
3-Methyl-N'-[(E,2E)-3-(4-nitrophenyl)-2-propenylidene]-1H-pyrazole-5-carbohydrazide
CID 529185
Butoxy(triethyl)silane
CID 525735
tert-Butyl(ethoxy)dimethylsilane
CID 526489
1-Butanol, DMTBS
CID 529138
1-Triisopropylsilyloxybutane
CID 604346
Silane, (4-iodobutoxy)trimethyl-
CID 10978586
Tert-butyl-(3-iodopropoxy)-dimethylsilane
CID 11022956
Tert-butyl-(4,4-difluoro-4-iodobutoxy)-dimethylsilane
CID 177849977
Silane, [(5-iodopentyl)oxy]trimethyl-
CID 12429740
tert-butyl-[(2R,4R)-4-iodopentan-2-yl]oxy-dimethylsilane
CID 101906519
tert-butyl-[(2S,3R)-3-iodo-2-methylbutoxy]-dimethylsilane
CID 154722716

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(4-iodobutoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(4-iodobutoxy)-dimethylsilane (CID 4250746) is tert-butyl-(4-iodobutoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(4-iodobutoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(4-iodobutoxy)-dimethylsilane is CC(C)(C)[Si](C)(C)OCCCCI.
What is the InChIKey of tert-butyl-(4-iodobutoxy)-dimethylsilane?
The InChIKey is INGJYKISFRSCQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23IOSi/c1-10(2,3)13(4,5)12-9-7-6-8-11/h6-9H2,1-5H3.
What are the key properties of tert-butyl-(4-iodobutoxy)-dimethylsilane?
tert-butyl-(4-iodobutoxy)-dimethylsilane has a molecular weight of 314.28 g/mol, XLogP of 4.22, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(4-iodobutoxy)-dimethylsilane is sourced from PubChem (CID 4250746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).