1,3-Bis[(Trimethylsilyl)Ethynyl]Benzene

• CAS: 38170-80-8
• Catalog Number: ACM38170808
• Category: Alkyl Silane
• Molecular Weight: 270.52 g/mol
• Molecular Formula: C16H22Si2
• Synonyms: (Benzene-1,3-Diyldiethyne-2,1-Diyl)Bis(Trimethylsilane)
• IUPAC Name: trimethyl-[2-[3-(2-trimethylsilylethynyl)phenyl]ethynyl]silane
• SMILES: C[Si](C)(C)C#CC1=CC(=CC=C1)C#C[Si](C)(C)C
• InChI Key: ASZOZZMGMNVKDV-UHFFFAOYSA-N
• Boiling Point: 304.9 °C(760 mmHg)
• Melting Point: 57 °C
• Flash Point: 120.9 °C
• Density: 0.92 g/mL
• Solubility: Soluble in Toluene.
• Appearance: White to Almost white powder to crystal
• Storage: Ambient temperatures.
• Exact Mass: 270.12600
• MDL Number: MFCD00078305
• Packaging: 10 g; 100 g
• PubChem ID: 87560314
• Refractive Index: 1.505
• Safety Description: S22-S24/25

Custom Q&A

What is the molecular formula of 1,3-Bis[(trimethylsilyl)ethynyl]benzene?

The molecular formula of 1,3-Bis[(trimethylsilyl)ethynyl]benzene is C16H22Si2.

What is the IUPAC name of 1,3-Bis[(trimethylsilyl)ethynyl]benzene?

The IUPAC name of 1,3-Bis[(trimethylsilyl)ethynyl]benzene is trimethyl-[2-[3-(2-trimethylsilylethynyl)phenyl]ethynyl]silane.

What is the InChI of 1,3-Bis[(trimethylsilyl)ethynyl]benzene?

The InChI of 1,3-Bis[(trimethylsilyl)ethynyl]benzene is InChI=1S/C16H22Si2/c1-17(2,3)12-10-15-8-7-9-16(14-15)11-13-18(4,5)6/h7-9,14H,1-6H3.

What is the InChIKey of 1,3-Bis[(trimethylsilyl)ethynyl]benzene?

The InChIKey of 1,3-Bis[(trimethylsilyl)ethynyl]benzene is ASZOZZMGMNVKDV-UHFFFAOYSA-N.

What is the canonical SMILES of 1,3-Bis[(trimethylsilyl)ethynyl]benzene?

The canonical SMILES of 1,3-Bis[(trimethylsilyl)ethynyl]benzene is C[Si](C)(C)C#CC1=CC(=CC=C1)C#C[Si](C)(C)C.

What is the CAS number of 1,3-Bis[(trimethylsilyl)ethynyl]benzene?

The CAS number of 1,3-Bis[(trimethylsilyl)ethynyl]benzene is 38170-80-8.

What is the molecular weight of 1,3-Bis[(trimethylsilyl)ethynyl]benzene?

The molecular weight of 1,3-Bis[(trimethylsilyl)ethynyl]benzene is 270.52 g/mol.

How many hydrogen bond donor counts does 1,3-Bis[(trimethylsilyl)ethynyl]benzene have?

1,3-Bis[(trimethylsilyl)ethynyl]benzene has 0 hydrogen bond donor count.

How many rotatable bond counts does 1,3-Bis[(trimethylsilyl)ethynyl]benzene have?

1,3-Bis[(trimethylsilyl)ethynyl]benzene has 4 rotatable bond counts.

Is 1,3-Bis[(trimethylsilyl)ethynyl]benzene a canonicalized compound?

Yes, 1,3-Bis[(trimethylsilyl)ethynyl]benzene is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 108-36-1
• 1066-54-2

• 4526-07-2
• 38170-80-8

Reference: [1]Journal of Organic Chemistry,1988,vol. 53,p. 2489 - 2496

Upstream Synthesis Route 2

• 1066-54-2

• 4526-07-2
• 38170-80-8

Reference: [1]Journal of Organic Chemistry,1988,vol. 53,p. 2489 - 2496

Downstream Synthesis Route 1

• 38170-80-8

• 1785-61-1

Reference: [1]Journal of Organic Chemistry,1988,vol. 53,p. 2489 - 2496

* For details of the synthesis route, please refer to the original source to ensure accuracy.