tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane

C11H26O2SSi — CID 10332372

IUPACtert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane
SMILESC[S@](=O)CCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2SSi/c1-11(2,3)15(5,6)13-9-7-8-10-14(4)12/h7-10H2,1-6H3/t14-/m0/s1
InChIKeyXDRAPABAOUDCJJ-AWEZNQCLSA-N
MW250.48 g/mol
LogP3.17
Rot. Bonds6

About tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane

tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane (PubChem CID 10332372) has the molecular formula C11H26O2SSi and a molecular weight of 250.48 g/mol. Its IUPAC name is tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane
PubChem CID10332372
Molecular FormulaC11H26O2SSi
Molecular Weight250.48 g/mol
Exact Mass250.14
IUPAC Nametert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane
SMILESC[S@](=O)CCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2SSi/c1-11(2,3)15(5,6)13-9-7-8-10-14(4)12/h7-10H2,1-6H3/t14-/m0/s1
InChIKeyXDRAPABAOUDCJJ-AWEZNQCLSA-N
XLogP3.17
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.48
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-dimethylsilane
CID 529127
tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
CID 6430197
7-[tert-butyl(dimethyl)silyl]oxyheptyl acetate
CID 102305322
tert-butyl-hexacosoxy-dimethylsilane
CID 6430213
acetic acid;6-[tert-butyl(dimethyl)silyl]oxyhexan-1-ol
CID 71376160
22-[tert-butyl(dimethyl)silyl]oxydocosan-1-ol
CID 15229755
8-[tert-butyl(dimethyl)silyl]oxyoctan-1-ol
CID 11043515
azane;butoxy-tert-butyl-dimethylsilane
CID 87971025
tert-butyl-(4,4-dimethylpentoxy)-dimethylsilane
CID 59819312
[tert-butyl(dimethyl)silyl] 5-[tert-butyl(dimethyl)silyl]oxypentanoate
CID 22907893
3-[tert-butyl(dimethyl)silyl]oxypropane-1-sulfonamide
CID 153437849

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane (CID 10332372) is tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane is C[S@](=O)CCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane?
The InChIKey is XDRAPABAOUDCJJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C11H26O2SSi/c1-11(2,3)15(5,6)13-9-7-8-10-14(4)12/h7-10H2,1-6H3/t14-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane?
tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane has a molecular weight of 250.48 g/mol, XLogP of 3.17, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane is sourced from PubChem (CID 10332372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).