tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane

C16H34O2SSi2 — CID 139700383

IUPACtert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCCC1CCSC=C1O[Si](C)(C)C
InChIInChI=1S/C16H34O2SSi2/c1-16(2,3)21(7,8)17-11-9-14-10-12-19-13-15(14)18-20(4,5)6/h13-14H,9-12H2,1-8H3
InChIKeyRVASGNKLISCIBE-UHFFFAOYSA-N
MW346.69 g/mol
LogP5.84
Rot. Bonds6

About tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane

tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane (PubChem CID 139700383) has the molecular formula C16H34O2SSi2 and a molecular weight of 346.69 g/mol. Its IUPAC name is tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane
PubChem CID139700383
Molecular FormulaC16H34O2SSi2
Molecular Weight346.69 g/mol
Exact Mass346.18
IUPAC Nametert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCCC1CCSC=C1O[Si](C)(C)C
InChIInChI=1S/C16H34O2SSi2/c1-16(2,3)21(7,8)17-11-9-14-10-12-19-13-15(14)18-20(4,5)6/h13-14H,9-12H2,1-8H3
InChIKeyRVASGNKLISCIBE-UHFFFAOYSA-N
XLogP5.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.69
LogP ≤ 55.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-[3-(5-trimethylsilyloxy-3,4-dihydro-2H-pyran-4-yl)propoxy]silane
CID 139700392
methyl 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-oxothiane-2-carboxylate
CID 139700390
3-[2-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopentane-1,2-dione
CID 101218952
[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]cyclohexyl]methanol
CID 140982899
tert-butyl-[2-[(1S)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-trimethylsilyloxycyclohex-2-en-1-yl]propoxy]-dimethylsilane
CID 177446377
2,6-bis[4-[tert-butyl(dimethyl)silyl]oxybutyl]cyclohexan-1-one
CID 10928807
cis-(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]cyclohexan-1-one
CID 91867075
[(2R,5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol
CID 11459641
tert-butyl-[2-[(2S,3R)-3-ethylaziridin-2-yl]ethoxy]-dimethylsilane
CID 99771220
2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclobutan-1-amine
CID 19794261
tert-butyl-dimethyl-[2-[(2R,3S)-3-methyl-6-methylideneoxan-2-yl]ethoxy]silane
CID 10564008
1-[(9R)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-iodo-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepin-3-yl]-2,2,2-trifluoroethanone
CID 53360447

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane (CID 139700383) is tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane is CC(C)(C)[Si](C)(C)OCCC1CCSC=C1O[Si](C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane?
The InChIKey is RVASGNKLISCIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2SSi2/c1-16(2,3)21(7,8)17-11-9-14-10-12-19-13-15(14)18-20(4,5)6/h13-14H,9-12H2,1-8H3.
What are the key properties of tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane?
tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane has a molecular weight of 346.69 g/mol, XLogP of 5.84, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[2-(5-trimethylsilyloxy-3,4-dihydro-2H-thiopyran-4-yl)ethoxy]silane is sourced from PubChem (CID 139700383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).