dichloro(2-chlorobut-3-enyl)silane

C4H7Cl3Si — CID 173121310

IUPACdichloro(2-chlorobut-3-enyl)silane
SMILESC=CC(Cl)C[SiH](Cl)Cl
InChIInChI=1S/C4H7Cl3Si/c1-2-4(5)3-8(6)7/h2,4,8H,1,3H2
InChIKeyUNIQJZZLZVPBQD-UHFFFAOYSA-N
MW189.54 g/mol
LogP2.48
Rot. Bonds3

About dichloro(2-chlorobut-3-enyl)silane

dichloro(2-chlorobut-3-enyl)silane (PubChem CID 173121310) has the molecular formula C4H7Cl3Si and a molecular weight of 189.54 g/mol. Its IUPAC name is dichloro(2-chlorobut-3-enyl)silane.

Molecular Properties

Compound Namedichloro(2-chlorobut-3-enyl)silane
PubChem CID173121310
Molecular FormulaC4H7Cl3Si
Molecular Weight189.54 g/mol
Exact Mass187.94
IUPAC Namedichloro(2-chlorobut-3-enyl)silane
SMILESC=CC(Cl)C[SiH](Cl)Cl
InChIInChI=1S/C4H7Cl3Si/c1-2-4(5)3-8(6)7/h2,4,8H,1,3H2
InChIKeyUNIQJZZLZVPBQD-UHFFFAOYSA-N
XLogP2.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.54
LogP ≤ 52.48
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

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3-chloropenta-1,4-diene;silane
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but-3-en-2-yl(dichloro)silane
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dichloro(oct-7-enyl)silane
CID 123651702
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Frequently Asked Questions

What is the IUPAC name of dichloro(2-chlorobut-3-enyl)silane?
The IUPAC name of dichloro(2-chlorobut-3-enyl)silane (CID 173121310) is dichloro(2-chlorobut-3-enyl)silane.
What is the SMILES notation for dichloro(2-chlorobut-3-enyl)silane?
The canonical SMILES for dichloro(2-chlorobut-3-enyl)silane is C=CC(Cl)C[SiH](Cl)Cl.
What is the InChIKey of dichloro(2-chlorobut-3-enyl)silane?
The InChIKey is UNIQJZZLZVPBQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7Cl3Si/c1-2-4(5)3-8(6)7/h2,4,8H,1,3H2.
What are the key properties of dichloro(2-chlorobut-3-enyl)silane?
dichloro(2-chlorobut-3-enyl)silane has a molecular weight of 189.54 g/mol, XLogP of 2.48, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(2-chlorobut-3-enyl)silane is sourced from PubChem (CID 173121310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).