dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane

C18H28Si — CID 21254270

IUPACdimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane
SMILESCC1=C(C)C(C)=C([Si](C)(C)C2=C(C)C(C)=C(C)C2)C1
InChIInChI=1S/C18H28Si/c1-11-9-17(15(5)13(11)3)19(7,8)18-10-12(2)14(4)16(18)6/h9-10H2,1-8H3
InChIKeyBVQXLIXKINXBCE-UHFFFAOYSA-N
MW272.51 g/mol
LogP5.89
Rot. Bonds2

About dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane

dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane (PubChem CID 21254270) has the molecular formula C18H28Si and a molecular weight of 272.51 g/mol. Its IUPAC name is dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane.

Molecular Properties

Compound Namedimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane
PubChem CID21254270
Molecular FormulaC18H28Si
Molecular Weight272.51 g/mol
Exact Mass272.20
IUPAC Namedimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane
SMILESCC1=C(C)C(C)=C([Si](C)(C)C2=C(C)C(C)=C(C)C2)C1
InChIInChI=1S/C18H28Si/c1-11-9-17(15(5)13(11)3)19(7,8)18-10-12(2)14(4)16(18)6/h9-10H2,1-8H3
InChIKeyBVQXLIXKINXBCE-UHFFFAOYSA-N
XLogP5.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.51
LogP ≤ 55.89
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 dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane?
The IUPAC name of dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane (CID 21254270) is dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane.
What is the SMILES notation for dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane?
The canonical SMILES for dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane is CC1=C(C)C(C)=C([Si](C)(C)C2=C(C)C(C)=C(C)C2)C1.
What is the InChIKey of dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane?
The InChIKey is BVQXLIXKINXBCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28Si/c1-11-9-17(15(5)13(11)3)19(7,8)18-10-12(2)14(4)16(18)6/h9-10H2,1-8H3.
What are the key properties of dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane?
dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane has a molecular weight of 272.51 g/mol, XLogP of 5.89, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(2,3,4-trimethylcyclopenta-1,3-dien-1-yl)silane is sourced from PubChem (CID 21254270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).