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

C18H26Cl2Si — CID 139699545

IUPACdichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=CC(C)([Si](Cl)(Cl)C2(C)C=C(C)C(C)=C2C)C(C)=C1C
InChIInChI=1S/C18H26Cl2Si/c1-11-9-17(7,15(5)13(11)3)21(19,20)18(8)10-12(2)14(4)16(18)6/h9-10H,1-8H3
InChIKeyXYEIEULQTSRMAW-UHFFFAOYSA-N
MW341.40 g/mol
LogP7.02
Rot. Bonds2

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

dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane (PubChem CID 139699545) has the molecular formula C18H26Cl2Si and a molecular weight of 341.40 g/mol. Its IUPAC name is dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane.

Molecular Properties

Compound Namedichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane
PubChem CID139699545
Molecular FormulaC18H26Cl2Si
Molecular Weight341.40 g/mol
Exact Mass340.12
IUPAC Namedichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=CC(C)([Si](Cl)(Cl)C2(C)C=C(C)C(C)=C2C)C(C)=C1C
InChIInChI=1S/C18H26Cl2Si/c1-11-9-17(7,15(5)13(11)3)21(19,20)18(8)10-12(2)14(4)16(18)6/h9-10H,1-8H3
InChIKeyXYEIEULQTSRMAW-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'}

Analyze dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The IUPAC name of dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane (CID 139699545) is dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane.
What is the SMILES notation for dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The canonical SMILES for dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane is CC1=CC(C)([Si](Cl)(Cl)C2(C)C=C(C)C(C)=C2C)C(C)=C1C.
What is the InChIKey of dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The InChIKey is XYEIEULQTSRMAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26Cl2Si/c1-11-9-17(7,15(5)13(11)3)21(19,20)18(8)10-12(2)14(4)16(18)6/h9-10H,1-8H3.
What are the key properties of dichloro-bis(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane?
dichloro-bis(1,2,3,4-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(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane is sourced from PubChem (CID 139699545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).