[tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate

C10H22O2SSi — CID 71312541

IUPAC[tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate
SMILESC=C(C)CS(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H22O2SSi/c1-9(2)8-13(11)12-14(6,7)10(3,4)5/h1,8H2,2-7H3
InChIKeyGPBFOXFZOXHPIC-UHFFFAOYSA-N
MW234.44 g/mol
LogP3.25
Rot. Bonds4

About [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate

[tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate (PubChem CID 71312541) has the molecular formula C10H22O2SSi and a molecular weight of 234.44 g/mol. Its IUPAC name is [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate.

Molecular Properties

Compound Name[tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate
PubChem CID71312541
Molecular FormulaC10H22O2SSi
Molecular Weight234.44 g/mol
Exact Mass234.11
IUPAC Name[tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate
SMILESC=C(C)CS(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H22O2SSi/c1-9(2)8-13(11)12-14(6,7)10(3,4)5/h1,8H2,2-7H3
InChIKeyGPBFOXFZOXHPIC-UHFFFAOYSA-N
XLogP3.25
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.44
LogP ≤ 53.25
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

trimethylsilyl 2-methylprop-2-ene-1-sulfinate
CID 71312539
2-methyl-3-methylsulfinylprop-1-ene
CID 89314117
2-methylprop-2-ene-1-sulfinate
CID 5035958
tert-butyl-(2,3-dimethylbut-3-en-2-yloxy)-dimethylsilane
CID 12568514
(NE,S)-N-[1-[tert-butyl(dimethyl)silyl]oxypropan-2-ylidene]-2-methylpropane-2-sulfinamide
CID 90089971
tert-butyl-dimethyl-(3-methylbut-3-en-2-yloxy)silane
CID 15935934
tert-butyl-dimethyl-[4-[(S)-methylsulfinyl]butoxy]silane
CID 10332372
tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane
CID 101446444
(2R,3S)-1-[tert-butyl(dimethyl)silyl]oxy-3-methoxy-5-methylhex-5-en-2-ol
CID 58797956
1-[(1S,2S,3R,5S,6R)-2,5-bis[[tert-butyl(dimethyl)silyl]oxy]-7-oxabicyclo[4.1.0]heptan-3-yl]-3-methylbut-3-en-1-one
CID 10765587
trimethyl(2-methylprop-2-enoxy)silane
CID 582142
[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopentyl] 2-methylprop-2-enoate
CID 89027286

Frequently Asked Questions

What is the IUPAC name of [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate?
The IUPAC name of [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate (CID 71312541) is [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate.
What is the SMILES notation for [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate?
The canonical SMILES for [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate is C=C(C)CS(=O)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate?
The InChIKey is GPBFOXFZOXHPIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2SSi/c1-9(2)8-13(11)12-14(6,7)10(3,4)5/h1,8H2,2-7H3.
What are the key properties of [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate?
[tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate has a molecular weight of 234.44 g/mol, XLogP of 3.25, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [tert-butyl(dimethyl)silyl] 2-methylprop-2-ene-1-sulfinate is sourced from PubChem (CID 71312541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).