tert-butyl-dichloro-prop-2-enylsilane

C7H14Cl2Si — CID 15447228

IUPACtert-butyl-dichloro-prop-2-enylsilane
SMILESC=CC[Si](Cl)(Cl)C(C)(C)C
InChIInChI=1S/C7H14Cl2Si/c1-5-6-10(8,9)7(2,3)4/h5H,1,6H2,2-4H3
InChIKeySSUSKRUVWRSRLI-UHFFFAOYSA-N
MW197.18 g/mol
LogP3.89
Rot. Bonds2

About tert-butyl-dichloro-prop-2-enylsilane

tert-butyl-dichloro-prop-2-enylsilane (PubChem CID 15447228) has the molecular formula C7H14Cl2Si and a molecular weight of 197.18 g/mol. Its IUPAC name is tert-butyl-dichloro-prop-2-enylsilane.

Molecular Properties

Compound Nametert-butyl-dichloro-prop-2-enylsilane
PubChem CID15447228
Molecular FormulaC7H14Cl2Si
Molecular Weight197.18 g/mol
Exact Mass196.02
IUPAC Nametert-butyl-dichloro-prop-2-enylsilane
SMILESC=CC[Si](Cl)(Cl)C(C)(C)C
InChIInChI=1S/C7H14Cl2Si/c1-5-6-10(8,9)7(2,3)4/h5H,1,6H2,2-4H3
InChIKeySSUSKRUVWRSRLI-UHFFFAOYSA-N
XLogP3.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.18
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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-dichloro-prop-2-enylsilane?
The IUPAC name of tert-butyl-dichloro-prop-2-enylsilane (CID 15447228) is tert-butyl-dichloro-prop-2-enylsilane.
What is the SMILES notation for tert-butyl-dichloro-prop-2-enylsilane?
The canonical SMILES for tert-butyl-dichloro-prop-2-enylsilane is C=CC[Si](Cl)(Cl)C(C)(C)C.
What is the InChIKey of tert-butyl-dichloro-prop-2-enylsilane?
The InChIKey is SSUSKRUVWRSRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14Cl2Si/c1-5-6-10(8,9)7(2,3)4/h5H,1,6H2,2-4H3.
What are the key properties of tert-butyl-dichloro-prop-2-enylsilane?
tert-butyl-dichloro-prop-2-enylsilane has a molecular weight of 197.18 g/mol, XLogP of 3.89, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dichloro-prop-2-enylsilane is sourced from PubChem (CID 15447228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).