tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane

C10H22O2SSi — CID 132511996

IUPACtert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane
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
InChIKeyPBZMDUKWVGSPCW-UHFFFAOYSA-N
MW234.44 g/mol
LogP2.98
Rot. Bonds3

About tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane

tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane (PubChem CID 132511996) has the molecular formula C10H22O2SSi and a molecular weight of 234.44 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane
PubChem CID132511996
Molecular FormulaC10H22O2SSi
Molecular Weight234.44 g/mol
Exact Mass234.11
IUPAC Nametert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane
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
InChIKeyPBZMDUKWVGSPCW-UHFFFAOYSA-N
XLogP2.98
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.44
LogP ≤ 52.98
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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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane?
The IUPAC name of tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane (CID 132511996) is tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane.
What is the SMILES notation for tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane?
The canonical SMILES for tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane is C=C(C)CS(=O)(=O)[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane?
The InChIKey is PBZMDUKWVGSPCW-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-(2-methylprop-2-enylsulfonyl)silane?
tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane has a molecular weight of 234.44 g/mol, XLogP of 2.98, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2-methylprop-2-enylsulfonyl)silane is sourced from PubChem (CID 132511996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).