tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane

C10H21Cl3O2Si2 — CID 10640561

IUPACtert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane
SMILESC=C(O[Si](Cl)(Cl)Cl)[C@@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H21Cl3O2Si2/c1-8(9(2)15-17(11,12)13)14-16(6,7)10(3,4)5/h8H,2H2,1,3-7H3/t8-/m1/s1
InChIKeyWCKQEDQZRYXNQZ-MRVPVSSYSA-N
MW335.81 g/mol
LogP5.08
Rot. Bonds5

About tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane

tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane (PubChem CID 10640561) has the molecular formula C10H21Cl3O2Si2 and a molecular weight of 335.81 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane
PubChem CID10640561
Molecular FormulaC10H21Cl3O2Si2
Molecular Weight335.81 g/mol
Exact Mass334.01
IUPAC Nametert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane
SMILESC=C(O[Si](Cl)(Cl)Cl)[C@@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H21Cl3O2Si2/c1-8(9(2)15-17(11,12)13)14-16(6,7)10(3,4)5/h8H,2H2,1,3-7H3/t8-/m1/s1
InChIKeyWCKQEDQZRYXNQZ-MRVPVSSYSA-N
XLogP5.08
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.81
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane (CID 10640561) is tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane is C=C(O[Si](Cl)(Cl)Cl)[C@@H](C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane?
The InChIKey is WCKQEDQZRYXNQZ-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H21Cl3O2Si2/c1-8(9(2)15-17(11,12)13)14-16(6,7)10(3,4)5/h8H,2H2,1,3-7H3/t8-/m1/s1.
What are the key properties of tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane?
tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane has a molecular weight of 335.81 g/mol, XLogP of 5.08, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(2R)-3-trichlorosilyloxybut-3-en-2-yl]oxysilane is sourced from PubChem (CID 10640561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).