dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane

C18H26Cl2Si — CID 10936760

IUPACdichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=C(C)C([Si](Cl)(Cl)C2C(C)=C(C)C(C)=C2C)C(C)=C1C
InChIInChI=1S/C18H26Cl2Si/c1-9-10(2)14(6)17(13(9)5)21(19,20)18-15(7)11(3)12(4)16(18)8/h17-18H,1-8H3
InChIKeyAOQJZPDSXBJADH-UHFFFAOYSA-N
MW341.40 g/mol
LogP7.02
Rot. Bonds2

About dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane

dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane (PubChem CID 10936760) has the molecular formula C18H26Cl2Si and a molecular weight of 341.40 g/mol. Its IUPAC name is dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane.

Molecular Properties

Compound Namedichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
PubChem CID10936760
Molecular FormulaC18H26Cl2Si
Molecular Weight341.40 g/mol
Exact Mass340.12
IUPAC Namedichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=C(C)C([Si](Cl)(Cl)C2C(C)=C(C)C(C)=C2C)C(C)=C1C
InChIInChI=1S/C18H26Cl2Si/c1-9-10(2)14(6)17(13(9)5)21(19,20)18-15(7)11(3)12(4)16(18)8/h17-18H,1-8H3
InChIKeyAOQJZPDSXBJADH-UHFFFAOYSA-N
XLogP7.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.40
LogP ≤ 57.02
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-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The IUPAC name of dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane (CID 10936760) is dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane.
What is the SMILES notation for dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The canonical SMILES for dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane is CC1=C(C)C([Si](Cl)(Cl)C2C(C)=C(C)C(C)=C2C)C(C)=C1C.
What is the InChIKey of dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The InChIKey is AOQJZPDSXBJADH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26Cl2Si/c1-9-10(2)14(6)17(13(9)5)21(19,20)18-15(7)11(3)12(4)16(18)8/h17-18H,1-8H3.
What are the key properties of dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane has a molecular weight of 341.40 g/mol, XLogP of 7.02, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-bis(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane is sourced from PubChem (CID 10936760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).