tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane

C13H22OSSi — CID 102114871

IUPACtert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane
SMILESC=C[C@H](O[Si](C)(C)C(C)(C)C)c1cccs1
InChIInChI=1S/C13H22OSSi/c1-7-11(12-9-8-10-15-12)14-16(5,6)13(2,3)4/h7-11H,1H2,2-6H3/t11-/m0/s1
InChIKeyCVHXFFWXPFXRRU-NSHDSACASA-N
MW254.47 g/mol
LogP5.00
Rot. Bonds4

About tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane

tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane (PubChem CID 102114871) has the molecular formula C13H22OSSi and a molecular weight of 254.47 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane
PubChem CID102114871
Molecular FormulaC13H22OSSi
Molecular Weight254.47 g/mol
Exact Mass254.12
IUPAC Nametert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane
SMILESC=C[C@H](O[Si](C)(C)C(C)(C)C)c1cccs1
InChIInChI=1S/C13H22OSSi/c1-7-11(12-9-8-10-15-12)14-16(5,6)13(2,3)4/h7-11H,1H2,2-6H3/t11-/m0/s1
InChIKeyCVHXFFWXPFXRRU-NSHDSACASA-N
XLogP5.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.47
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-thiophen-2-ylprop-2-enyl hydrogen carbonate
CID 101142664
tert-butyl-(4,4-dimethylpent-1-en-3-yloxy)-dimethylsilane
CID 14644027
tert-butyl-dimethyl-thiophen-2-yloxysilane
CID 11053031
tert-butyl-dimethyl-[(3S)-4-phenylpent-1-en-3-yl]oxysilane
CID 154488375
4-[tert-butyl(dimethyl)silyl]oxy-2-thiophen-2-ylbutan-1-amine
CID 18354459
1-[tert-butyl(dimethyl)silyl]oxy-1-phenylbut-3-en-2-amine
CID 66693822
tert-butyl-[(E,1S)-4-methoxy-1,4-diphenylbut-2-enoxy]-dimethylsilane
CID 101242327
(1R,2S)-2-methyl-1-thiophen-2-ylbut-3-en-1-ol
CID 11651207
tert-butyl-[1-[3-iodo-1-(methoxymethyl)indol-2-yl]prop-2-enoxy]-dimethylsilane
CID 134949002
tert-butyl-dimethyl-(1-phenylbut-3-enoxy)silane
CID 11230810
2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene
CID 141305059
tert-butyl-dimethyl-[(2S,3R)-3-phenylmethoxypent-4-en-2-yl]oxysilane
CID 73333549

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane (CID 102114871) is tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane is C=C[C@H](O[Si](C)(C)C(C)(C)C)c1cccs1.
What is the InChIKey of tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane?
The InChIKey is CVHXFFWXPFXRRU-NSHDSACASA-N. The full InChI is InChI=1S/C13H22OSSi/c1-7-11(12-9-8-10-15-12)14-16(5,6)13(2,3)4/h7-11H,1H2,2-6H3/t11-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane?
tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane has a molecular weight of 254.47 g/mol, XLogP of 5.00, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(1S)-1-thiophen-2-ylprop-2-enoxy]silane is sourced from PubChem (CID 102114871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).