3-Ethynyltoluene

• CAS: 766-82-5
• Catalog Number: ACM766825
• Category: Alkynes
• Molecular Weight: 116.16
• Molecular Formula: C₉H₇Br
• Hazard Statements: H226-H315-H319-H335
• RIDADR: UN 3295C 3 / PGIII
• Symbol: GHS02

Custom Q&A

What is the molecular formula of 3-Ethynyltoluene?

The molecular formula of 3-Ethynyltoluene is C9H8.

What is the molecular weight of 3-Ethynyltoluene?

The molecular weight of 3-Ethynyltoluene is 116.16 g/mol.

What is the IUPAC name of 3-Ethynyltoluene?

The IUPAC name of 3-Ethynyltoluene is 1-ethynyl-3-methylbenzene.

What is the InChI of 3-Ethynyltoluene?

The InChI of 3-Ethynyltoluene is InChI=1S/C9H8/c1-3-9-6-4-5-8(2)7-9/h1,4-7H,2H3.

What is the InChIKey of 3-Ethynyltoluene?

The InChIKey of 3-Ethynyltoluene is RENYIDZOAFFNHC-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Ethynyltoluene?

The canonical SMILES of 3-Ethynyltoluene is CC1=CC(=CC=C1)C#C.

What is the CAS number of 3-Ethynyltoluene?

The CAS number of 3-Ethynyltoluene is 766-82-5.

What is the XLogP3 value of 3-Ethynyltoluene?

The XLogP3 value of 3-Ethynyltoluene is 3.1.

How many rotatable bonds does 3-Ethynyltoluene have?

3-Ethynyltoluene has 1 rotatable bond.

Is 3-Ethynyltoluene a covalently-bonded unit count?

Yes, 3-Ethynyltoluene is a covalently-bonded unit count.