but-2-enyl(trichloro)silane

C4H7Cl3Si — CID 543214

IUPACbut-2-enyl(trichloro)silane
SMILESCC=CC[Si](Cl)(Cl)Cl
InChIInChI=1S/C4H7Cl3Si/c1-2-3-4-8(5,6)7/h2-3H,4H2,1H3
InChIKeyZJDOJJKRTWHPOY-UHFFFAOYSA-N
MW189.54 g/mol
LogP3.22
Rot. Bonds2

About but-2-enyl(trichloro)silane

but-2-enyl(trichloro)silane (PubChem CID 543214) has the molecular formula C4H7Cl3Si and a molecular weight of 189.54 g/mol. Its IUPAC name is but-2-enyl(trichloro)silane.

Molecular Properties

Compound Namebut-2-enyl(trichloro)silane
PubChem CID543214
Molecular FormulaC4H7Cl3Si
Molecular Weight189.54 g/mol
Exact Mass187.94
IUPAC Namebut-2-enyl(trichloro)silane
SMILESCC=CC[Si](Cl)(Cl)Cl
InChIInChI=1S/C4H7Cl3Si/c1-2-3-4-8(5,6)7/h2-3H,4H2,1H3
InChIKeyZJDOJJKRTWHPOY-UHFFFAOYSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.54
LogP ≤ 53.22
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 but-2-enyl(trichloro)silane?
The IUPAC name of but-2-enyl(trichloro)silane (CID 543214) is but-2-enyl(trichloro)silane.
What is the SMILES notation for but-2-enyl(trichloro)silane?
The canonical SMILES for but-2-enyl(trichloro)silane is CC=CC[Si](Cl)(Cl)Cl.
What is the InChIKey of but-2-enyl(trichloro)silane?
The InChIKey is ZJDOJJKRTWHPOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7Cl3Si/c1-2-3-4-8(5,6)7/h2-3H,4H2,1H3.
What are the key properties of but-2-enyl(trichloro)silane?
but-2-enyl(trichloro)silane has a molecular weight of 189.54 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-enyl(trichloro)silane is sourced from PubChem (CID 543214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).