dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane

C20H36Si3 — CID 19023875

IUPACdimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane
SMILESC[Si](C)(CC1=CC([Si](C)(C)C)=CC1)CC1=CC([Si](C)(C)C)=CC1
InChIInChI=1S/C20H36Si3/c1-21(2,3)19-11-9-17(13-19)15-23(7,8)16-18-10-12-20(14-18)22(4,5)6/h11-14H,9-10,15-16H2,1-8H3
InChIKeyPUKIZRAOUCLVLG-UHFFFAOYSA-N
MW360.77 g/mol
LogP6.96
Rot. Bonds6

About dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane

dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane (PubChem CID 19023875) has the molecular formula C20H36Si3 and a molecular weight of 360.77 g/mol. Its IUPAC name is dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane.

Molecular Properties

Compound Namedimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane
PubChem CID19023875
Molecular FormulaC20H36Si3
Molecular Weight360.77 g/mol
Exact Mass360.21
IUPAC Namedimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane
SMILESC[Si](C)(CC1=CC([Si](C)(C)C)=CC1)CC1=CC([Si](C)(C)C)=CC1
InChIInChI=1S/C20H36Si3/c1-21(2,3)19-11-9-17(13-19)15-23(7,8)16-18-10-12-20(14-18)22(4,5)6/h11-14H,9-10,15-16H2,1-8H3
InChIKeyPUKIZRAOUCLVLG-UHFFFAOYSA-N
XLogP6.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.77
LogP ≤ 56.96
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[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane?
The IUPAC name of dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane (CID 19023875) is dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane.
What is the SMILES notation for dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane?
The canonical SMILES for dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane is C[Si](C)(CC1=CC([Si](C)(C)C)=CC1)CC1=CC([Si](C)(C)C)=CC1.
What is the InChIKey of dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane?
The InChIKey is PUKIZRAOUCLVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36Si3/c1-21(2,3)19-11-9-17(13-19)15-23(7,8)16-18-10-12-20(14-18)22(4,5)6/h11-14H,9-10,15-16H2,1-8H3.
What are the key properties of dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane?
dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane has a molecular weight of 360.77 g/mol, XLogP of 6.96, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis[(3-trimethylsilylcyclopenta-1,3-dien-1-yl)methyl]silane is sourced from PubChem (CID 19023875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).