trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane

C19H32Si2 — CID 69456934

IUPACtrimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane
SMILESCC1=CC(C)(C#C[Si](C)(C)C)CC(C)(C#C[Si](C)(C)C)C1
InChIInChI=1S/C19H32Si2/c1-17-14-18(2,10-12-20(4,5)6)16-19(3,15-17)11-13-21(7,8)9/h14H,15-16H2,1-9H3
InChIKeyNOZVPWXPRXPEEV-UHFFFAOYSA-N
MW316.64 g/mol
LogP5.50
Rot. Bonds

About trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane

trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane (PubChem CID 69456934) has the molecular formula C19H32Si2 and a molecular weight of 316.64 g/mol. Its IUPAC name is trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane
PubChem CID69456934
Molecular FormulaC19H32Si2
Molecular Weight316.64 g/mol
Exact Mass316.20
IUPAC Nametrimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane
SMILESCC1=CC(C)(C#C[Si](C)(C)C)CC(C)(C#C[Si](C)(C)C)C1
InChIInChI=1S/C19H32Si2/c1-17-14-18(2,10-12-20(4,5)6)16-19(3,15-17)11-13-21(7,8)9/h14H,15-16H2,1-9H3
InChIKeyNOZVPWXPRXPEEV-UHFFFAOYSA-N
XLogP5.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.64
LogP ≤ 55.50
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane?
The IUPAC name of trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane (CID 69456934) is trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane.
What is the SMILES notation for trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane?
The canonical SMILES for trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane is CC1=CC(C)(C#C[Si](C)(C)C)CC(C)(C#C[Si](C)(C)C)C1.
What is the InChIKey of trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane?
The InChIKey is NOZVPWXPRXPEEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32Si2/c1-17-14-18(2,10-12-20(4,5)6)16-19(3,15-17)11-13-21(7,8)9/h14H,15-16H2,1-9H3.
What are the key properties of trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane?
trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane has a molecular weight of 316.64 g/mol, XLogP of 5.50, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[1,3,5-trimethyl-5-(2-trimethylsilylethynyl)cyclohex-2-en-1-yl]ethynyl]silane is sourced from PubChem (CID 69456934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).