trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane

C6H11Cl3Si — CID 12722894

IUPACtrimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane
SMILESC[Si](C)(C)/C=C/C(Cl)(Cl)Cl
InChIInChI=1S/C6H11Cl3Si/c1-10(2,3)5-4-6(7,8)9/h4-5H,1-3H3/b5-4+
InChIKeyUHERWKIDXNPKQW-SNAWJCMRSA-N
MW217.60 g/mol
LogP3.79
Rot. Bonds1

About trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane

trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane (PubChem CID 12722894) has the molecular formula C6H11Cl3Si and a molecular weight of 217.60 g/mol. Its IUPAC name is trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane
PubChem CID12722894
Molecular FormulaC6H11Cl3Si
Molecular Weight217.60 g/mol
Exact Mass215.97
IUPAC Nametrimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane
SMILESC[Si](C)(C)/C=C/C(Cl)(Cl)Cl
InChIInChI=1S/C6H11Cl3Si/c1-10(2,3)5-4-6(7,8)9/h4-5H,1-3H3/b5-4+
InChIKeyUHERWKIDXNPKQW-SNAWJCMRSA-N
XLogP3.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.60
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane?
The IUPAC name of trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane (CID 12722894) is trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane.
What is the SMILES notation for trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane?
The canonical SMILES for trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane is C[Si](C)(C)/C=C/C(Cl)(Cl)Cl.
What is the InChIKey of trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane?
The InChIKey is UHERWKIDXNPKQW-SNAWJCMRSA-N. The full InChI is InChI=1S/C6H11Cl3Si/c1-10(2,3)5-4-6(7,8)9/h4-5H,1-3H3/b5-4+.
What are the key properties of trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane?
trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane has a molecular weight of 217.60 g/mol, XLogP of 3.79, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-3,3,3-trichloroprop-1-enyl]silane is sourced from PubChem (CID 12722894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).