diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane

C24H40Si — CID 139672577

IUPACdiethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane
SMILESCCC1=CC([Si](CC)(CC)C2C=C(CC)C=C2C(C)C)C(C(C)C)=C1
InChIInChI=1S/C24H40Si/c1-9-19-13-21(17(5)6)23(15-19)25(11-3,12-4)24-16-20(10-2)14-22(24)18(7)8/h13-18,23-24H,9-12H2,1-8H3
InChIKeyZTODQIFPFRURGV-UHFFFAOYSA-N
MW356.67 g/mol
LogP8.08
Rot. Bonds8

About diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane

diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane (PubChem CID 139672577) has the molecular formula C24H40Si and a molecular weight of 356.67 g/mol. Its IUPAC name is diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane.

Molecular Properties

Compound Namediethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane
PubChem CID139672577
Molecular FormulaC24H40Si
Molecular Weight356.67 g/mol
Exact Mass356.29
IUPAC Namediethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane
SMILESCCC1=CC([Si](CC)(CC)C2C=C(CC)C=C2C(C)C)C(C(C)C)=C1
InChIInChI=1S/C24H40Si/c1-9-19-13-21(17(5)6)23(15-19)25(11-3,12-4)24-16-20(10-2)14-22(24)18(7)8/h13-18,23-24H,9-12H2,1-8H3
InChIKeyZTODQIFPFRURGV-UHFFFAOYSA-N
XLogP8.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.67
LogP ≤ 58.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane?
The IUPAC name of diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane (CID 139672577) is diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane.
What is the SMILES notation for diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane?
The canonical SMILES for diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane is CCC1=CC([Si](CC)(CC)C2C=C(CC)C=C2C(C)C)C(C(C)C)=C1.
What is the InChIKey of diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane?
The InChIKey is ZTODQIFPFRURGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H40Si/c1-9-19-13-21(17(5)6)23(15-19)25(11-3,12-4)24-16-20(10-2)14-22(24)18(7)8/h13-18,23-24H,9-12H2,1-8H3.
What are the key properties of diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane?
diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane has a molecular weight of 356.67 g/mol, XLogP of 8.08, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-bis(4-ethyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane is sourced from PubChem (CID 139672577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).