(3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane

C11H18Si — CID 18417286

IUPAC(3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane
SMILESC[Si](C)=C1C=CC(C(C)(C)C)=C1
InChIInChI=1S/C11H18Si/c1-11(2,3)9-6-7-10(8-9)12(4)5/h6-8H,1-5H3
InChIKeyFWZCBVGRBIZOEV-UHFFFAOYSA-N
MW178.35 g/mol
LogP3.04
Rot. Bonds

About (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane

(3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane (PubChem CID 18417286) has the molecular formula C11H18Si and a molecular weight of 178.35 g/mol. Its IUPAC name is (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane.

Molecular Properties

Compound Name(3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane
PubChem CID18417286
Molecular FormulaC11H18Si
Molecular Weight178.35 g/mol
Exact Mass178.12
IUPAC Name(3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane
SMILESC[Si](C)=C1C=CC(C(C)(C)C)=C1
InChIInChI=1S/C11H18Si/c1-11(2,3)9-6-7-10(8-9)12(4)5/h6-8H,1-5H3
InChIKeyFWZCBVGRBIZOEV-UHFFFAOYSA-N
XLogP3.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.35
LogP ≤ 53.04
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 (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane?
The IUPAC name of (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane (CID 18417286) is (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane.
What is the SMILES notation for (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane?
The canonical SMILES for (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane is C[Si](C)=C1C=CC(C(C)(C)C)=C1.
What is the InChIKey of (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane?
The InChIKey is FWZCBVGRBIZOEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18Si/c1-11(2,3)9-6-7-10(8-9)12(4)5/h6-8H,1-5H3.
What are the key properties of (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane?
(3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane has a molecular weight of 178.35 g/mol, XLogP of 3.04, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-tert-butylcyclopenta-2,4-dien-1-ylidene)-dimethylsilane is sourced from PubChem (CID 18417286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).