dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane

C22H30Cl4Si2 — CID 139674199

IUPACdichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane
SMILESCCc1ccc(C(C)C[Si](Cl)(Cl)CCc2cccc([Si](C)(Cl)Cl)c2CC)cc1
InChIInChI=1S/C22H30Cl4Si2/c1-5-18-10-12-19(13-11-18)17(3)16-28(25,26)15-14-20-8-7-9-22(21(20)6-2)27(4,23)24/h7-13,17H,5-6,14-16H2,1-4H3
InChIKeyQSOIQWCFPBYVIY-UHFFFAOYSA-N
MW492.47 g/mol
LogP7.83
Rot. Bonds9

About dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane

dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane (PubChem CID 139674199) has the molecular formula C22H30Cl4Si2 and a molecular weight of 492.47 g/mol. Its IUPAC name is dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane.

Molecular Properties

Compound Namedichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane
PubChem CID139674199
Molecular FormulaC22H30Cl4Si2
Molecular Weight492.47 g/mol
Exact Mass490.06
IUPAC Namedichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane
SMILESCCc1ccc(C(C)C[Si](Cl)(Cl)CCc2cccc([Si](C)(Cl)Cl)c2CC)cc1
InChIInChI=1S/C22H30Cl4Si2/c1-5-18-10-12-19(13-11-18)17(3)16-28(25,26)15-14-20-8-7-9-22(21(20)6-2)27(4,23)24/h7-13,17H,5-6,14-16H2,1-4H3
InChIKeyQSOIQWCFPBYVIY-UHFFFAOYSA-N
XLogP7.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.47
LogP ≤ 57.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane?
The IUPAC name of dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane (CID 139674199) is dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane.
What is the SMILES notation for dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane?
The canonical SMILES for dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane is CCc1ccc(C(C)C[Si](Cl)(Cl)CCc2cccc([Si](C)(Cl)Cl)c2CC)cc1.
What is the InChIKey of dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane?
The InChIKey is QSOIQWCFPBYVIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30Cl4Si2/c1-5-18-10-12-19(13-11-18)17(3)16-28(25,26)15-14-20-8-7-9-22(21(20)6-2)27(4,23)24/h7-13,17H,5-6,14-16H2,1-4H3.
What are the key properties of dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane?
dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane has a molecular weight of 492.47 g/mol, XLogP of 7.83, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-[3-[2-[dichloro-[2-(4-ethylphenyl)propyl]silyl]ethyl]-2-ethylphenyl]-methylsilane is sourced from PubChem (CID 139674199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).