bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane

C12H14Cl2Si — CID 141006638

IUPACbis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane
SMILESC[Si](C)(C1(Cl)C=CC=C1)C1(Cl)C=CC=C1
InChIInChI=1S/C12H14Cl2Si/c1-15(2,11(13)7-3-4-8-11)12(14)9-5-6-10-12/h3-10H,1-2H3
InChIKeyRRIWVBMAIVMMOF-UHFFFAOYSA-N
MW257.24 g/mol
LogP3.98
Rot. Bonds2

About bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane

bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane (PubChem CID 141006638) has the molecular formula C12H14Cl2Si and a molecular weight of 257.24 g/mol. Its IUPAC name is bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane.

Molecular Properties

Compound Namebis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane
PubChem CID141006638
Molecular FormulaC12H14Cl2Si
Molecular Weight257.24 g/mol
Exact Mass256.02
IUPAC Namebis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane
SMILESC[Si](C)(C1(Cl)C=CC=C1)C1(Cl)C=CC=C1
InChIInChI=1S/C12H14Cl2Si/c1-15(2,11(13)7-3-4-8-11)12(14)9-5-6-10-12/h3-10H,1-2H3
InChIKeyRRIWVBMAIVMMOF-UHFFFAOYSA-N
XLogP3.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.24
LogP ≤ 53.98
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 bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane?
The IUPAC name of bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane (CID 141006638) is bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane.
What is the SMILES notation for bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane?
The canonical SMILES for bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane is C[Si](C)(C1(Cl)C=CC=C1)C1(Cl)C=CC=C1.
What is the InChIKey of bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane?
The InChIKey is RRIWVBMAIVMMOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2Si/c1-15(2,11(13)7-3-4-8-11)12(14)9-5-6-10-12/h3-10H,1-2H3.
What are the key properties of bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane?
bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane has a molecular weight of 257.24 g/mol, XLogP of 3.98, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-chlorocyclopenta-2,4-dien-1-yl)-dimethylsilane is sourced from PubChem (CID 141006638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).