trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane

C14H22OSSi — CID 15361583

IUPACtrimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane
SMILESC[Si](C)(C)C(CC1COC1)Sc1ccccc1
InChIInChI=1S/C14H22OSSi/c1-17(2,3)14(9-12-10-15-11-12)16-13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3
InChIKeyDXVSSXAUEKFFRS-UHFFFAOYSA-N
MW266.48 g/mol
LogP4.06
Rot. Bonds5

About trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane

trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane (PubChem CID 15361583) has the molecular formula C14H22OSSi and a molecular weight of 266.48 g/mol. Its IUPAC name is trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane
PubChem CID15361583
Molecular FormulaC14H22OSSi
Molecular Weight266.48 g/mol
Exact Mass266.12
IUPAC Nametrimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane
SMILESC[Si](C)(C)C(CC1COC1)Sc1ccccc1
InChIInChI=1S/C14H22OSSi/c1-17(2,3)14(9-12-10-15-11-12)16-13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3
InChIKeyDXVSSXAUEKFFRS-UHFFFAOYSA-N
XLogP4.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.48
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2R)-N-ethyl-N-[[(3S)-oxolan-3-yl]methyl]-2-phenylsulfanylbutanamide
CID 95621072
(2-cyclohexylidene-1-phenylsulfanylethyl)-trimethylsilane
CID 13184528
[(E)-2,4-bis(phenylsulfanyl)but-3-enyl]-trimethylsilane
CID 11405220
[chloro(phenylsulfanyl)methyl]-dimethyl-phenylsilane
CID 44542727
trans-(1S,2R)-2-[2,2-bis(phenylsulfanyl)ethyl]-3,3-dimethylcyclohexan-1-ol
CID 11428732
2-phenylsulfanyl-2-triphenylsilylethanol
CID 10938546
N-methyl-N-(oxetan-3-ylmethyl)aniline
CID 130694307
[2-chloro-1-(4-chlorophenyl)sulfanylethyl]-trimethylsilane
CID 12605864
pent-3-en-2-ylsulfanylbenzene
CID 71350028
(2R,3S)-2,3-dimethyl-2-(2-phenylsulfanylbut-3-enyl)oxirane
CID 135037338
[(2S)-butan-2-yl]sulfanylbenzene
CID 12812299
1-fluoropropan-2-ylsulfanylbenzene
CID 15563457

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane?
The IUPAC name of trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane (CID 15361583) is trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane.
What is the SMILES notation for trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane?
The canonical SMILES for trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane is C[Si](C)(C)C(CC1COC1)Sc1ccccc1.
What is the InChIKey of trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane?
The InChIKey is DXVSSXAUEKFFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22OSSi/c1-17(2,3)14(9-12-10-15-11-12)16-13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3.
What are the key properties of trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane?
trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane has a molecular weight of 266.48 g/mol, XLogP of 4.06, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-(oxetan-3-yl)-1-phenylsulfanylethyl]silane is sourced from PubChem (CID 15361583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).