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Structure

2-[(Trimethylsilyl)Ethynyl]Toluene

CAS
3989-15-9
Catalog Number
ACM3989159
Category
Alkynes
Molecular Weight
188.34 g/mol
Molecular Formula
C12H16Si

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Specification

Synonyms
2-[(Trimethylsilyl)ethynyl]toluene; 1-(2-methylphenyl)-2-trimetylsilylethyne; 1-methyl-2-(1-trimethylsilylethynyl)benzene; trimethylsilyl(o-tolyl)acetylene; Trimethyl-o-tolylethynyl-silane; 1-methyl-2-[(2-trimethylsilyl)ethynyl]benzene; 2,6-BIS(P-TOLYL)PYRIDINE; Benzene,1-methyl-2-[2-(trimethylsilyl)ethynyl]; (2-(2-methylphenyl)ethynyl)trimethylsilane; trimethyl [(2-methylphenyl)ethynyl]silane; 1-trimethylsilyl-2-(2-methylphenyl)ethyne;
IUPAC Name
trimethyl-[2-(2-methylphenyl)ethynyl]silane
Canonical SMILES
CC1=CC=CC=C1C#C[Si](C)(C)C
InChI Key
POJCCZAVVWWXNS-UHFFFAOYSA-N
Boiling Point
50-60ºC0.5 mm Hg(lit.)
Flash Point
195 °F
Density
0.880 g/mL at 25ºC(lit.)
Appearance
Transparent liquid
Exact Mass
188.10200
Hazard Statements
H315-H319-H335
Packaging
10 g; 100 g;
RIDADR
UN 1993C 3 / PGIII
Safety Description
26-36
Symbol
GHS07
What is the IUPAC name of the compound?

The IUPAC name of the compound is trimethyl-[2-(2-methylphenyl)ethynyl]silane.

What is the molecular formula of the compound?

The molecular formula of the compound is C12H16Si.

What is the CAS number of the compound?

The CAS number of the compound is 3989-15-9.

What is the molecular weight of the compound?

The molecular weight of the compound is 188.34 g/mol.

How many hydrogen bond donor atoms does the compound have?

The compound has 0 hydrogen bond donor atoms.

What is the exact mass of the compound?

The exact mass of the compound is 188.102127045 g/mol.

How many rotatable bonds does the compound have?

The compound has 2 rotatable bonds.

What is the topological polar surface area of the compound?

The compound has a topological polar surface area of 0Ų.

How many heavy atoms does the compound have?

The compound has 13 heavy atoms.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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