benzene;bis(1,1,2-trimethylsilinane)

C22H42Si2 — CID 174956431

IUPACbenzene;bis(1,1,2-trimethylsilinane)
SMILESCC1CCCC[Si]1(C)C.CC1CCCC[Si]1(C)C.c1ccccc1
InChIInChI=1S/2C8H18Si.C6H6/c2*1-8-6-4-5-7-9(8,2)3;1-2-4-6-5-3-1/h2*8H,4-7H2,1-3H3;1-6H
InChIKeyDAFPVZQLNZBXIZ-UHFFFAOYSA-N
MW362.75 g/mol
LogP8.22
Rot. Bonds

About benzene;bis(1,1,2-trimethylsilinane)

benzene;bis(1,1,2-trimethylsilinane) (PubChem CID 174956431) has the molecular formula C22H42Si2 and a molecular weight of 362.75 g/mol. Its IUPAC name is benzene;bis(1,1,2-trimethylsilinane).

Molecular Properties

Compound Namebenzene;bis(1,1,2-trimethylsilinane)
PubChem CID174956431
Molecular FormulaC22H42Si2
Molecular Weight362.75 g/mol
Exact Mass362.28
IUPAC Namebenzene;bis(1,1,2-trimethylsilinane)
SMILESCC1CCCC[Si]1(C)C.CC1CCCC[Si]1(C)C.c1ccccc1
InChIInChI=1S/2C8H18Si.C6H6/c2*1-8-6-4-5-7-9(8,2)3;1-2-4-6-5-3-1/h2*8H,4-7H2,1-3H3;1-6H
InChIKeyDAFPVZQLNZBXIZ-UHFFFAOYSA-N
XLogP8.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.75
LogP ≤ 58.22
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 benzene;bis(1,1,2-trimethylsilinane)?
The IUPAC name of benzene;bis(1,1,2-trimethylsilinane) (CID 174956431) is benzene;bis(1,1,2-trimethylsilinane).
What is the SMILES notation for benzene;bis(1,1,2-trimethylsilinane)?
The canonical SMILES for benzene;bis(1,1,2-trimethylsilinane) is CC1CCCC[Si]1(C)C.CC1CCCC[Si]1(C)C.c1ccccc1.
What is the InChIKey of benzene;bis(1,1,2-trimethylsilinane)?
The InChIKey is DAFPVZQLNZBXIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H18Si.C6H6/c2*1-8-6-4-5-7-9(8,2)3;1-2-4-6-5-3-1/h2*8H,4-7H2,1-3H3;1-6H.
What are the key properties of benzene;bis(1,1,2-trimethylsilinane)?
benzene;bis(1,1,2-trimethylsilinane) has a molecular weight of 362.75 g/mol, XLogP of 8.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;bis(1,1,2-trimethylsilinane) is sourced from PubChem (CID 174956431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).