tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane

C11H22OSi — CID 132575047

IUPACtert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane
SMILESC/C(=C/[Si](C)(C)C(C)(C)C)[C@@H]1CO1
InChIInChI=1S/C11H22OSi/c1-9(10-7-12-10)8-13(5,6)11(2,3)4/h8,10H,7H2,1-6H3/b9-8-/t10-/m0/s1
InChIKeyQJRBSELHCVRARE-QROTZFDESA-N
MW198.38 g/mol
LogP3.38
Rot. Bonds2

About tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane

tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane (PubChem CID 132575047) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane
PubChem CID132575047
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Nametert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane
SMILESC/C(=C/[Si](C)(C)C(C)(C)C)[C@@H]1CO1
InChIInChI=1S/C11H22OSi/c1-9(10-7-12-10)8-13(5,6)11(2,3)4/h8,10H,7H2,1-6H3/b9-8-/t10-/m0/s1
InChIKeyQJRBSELHCVRARE-QROTZFDESA-N
XLogP3.38
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane?
The IUPAC name of tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane (CID 132575047) is tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane?
The canonical SMILES for tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane is C/C(=C/[Si](C)(C)C(C)(C)C)[C@@H]1CO1.
What is the InChIKey of tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane?
The InChIKey is QJRBSELHCVRARE-QROTZFDESA-N. The full InChI is InChI=1S/C11H22OSi/c1-9(10-7-12-10)8-13(5,6)11(2,3)4/h8,10H,7H2,1-6H3/b9-8-/t10-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane?
tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane has a molecular weight of 198.38 g/mol, XLogP of 3.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(Z)-2-[(2R)-oxiran-2-yl]prop-1-enyl]silane is sourced from PubChem (CID 132575047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).