[2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane

C19H40Si2 — CID 102154705

IUPAC[2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane
SMILESCC(C)(C)C1CCC(=C(C[Si](C)(C)C)C[Si](C)(C)C)CC1
InChIInChI=1S/C19H40Si2/c1-19(2,3)18-12-10-16(11-13-18)17(14-20(4,5)6)15-21(7,8)9/h18H,10-15H2,1-9H3
InChIKeyLYDJNBUYFAXIEU-UHFFFAOYSA-N
MW324.70 g/mol
LogP7.20
Rot. Bonds4

About [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane

[2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane (PubChem CID 102154705) has the molecular formula C19H40Si2 and a molecular weight of 324.70 g/mol. Its IUPAC name is [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane.

Molecular Properties

Compound Name[2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane
PubChem CID102154705
Molecular FormulaC19H40Si2
Molecular Weight324.70 g/mol
Exact Mass324.27
IUPAC Name[2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane
SMILESCC(C)(C)C1CCC(=C(C[Si](C)(C)C)C[Si](C)(C)C)CC1
InChIInChI=1S/C19H40Si2/c1-19(2,3)18-12-10-16(11-13-18)17(14-20(4,5)6)15-21(7,8)9/h18H,10-15H2,1-9H3
InChIKeyLYDJNBUYFAXIEU-UHFFFAOYSA-N
XLogP7.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.70
LogP ≤ 57.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane?
The IUPAC name of [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane (CID 102154705) is [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane.
What is the SMILES notation for [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane?
The canonical SMILES for [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane is CC(C)(C)C1CCC(=C(C[Si](C)(C)C)C[Si](C)(C)C)CC1.
What is the InChIKey of [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane?
The InChIKey is LYDJNBUYFAXIEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40Si2/c1-19(2,3)18-12-10-16(11-13-18)17(14-20(4,5)6)15-21(7,8)9/h18H,10-15H2,1-9H3.
What are the key properties of [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane?
[2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane has a molecular weight of 324.70 g/mol, XLogP of 7.20, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-tert-butylcyclohexylidene)-3-trimethylsilylpropyl]-trimethylsilane is sourced from PubChem (CID 102154705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).