3-Chloro-1-phenyl-1-propyne

• CAS: 3355-31-5
• Catalog Number: ACM3355315
• Category: Alkynes
• Molecular Weight: 150.60
• Molecular Formula: C9H7Cl
• Hazard Statements: H302-H317-H319
• RIDADR: UN1294 - class 3 - PG 2 - Toluene, solution
• Symbol: GHS07

Custom Q&A

What is the molecular formula of the compound?

The molecular formula of the compound is C9H7Cl.

What is the molecular weight of the compound?

The molecular weight of the compound is 150.60 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 3-chloroprop-1-ynylbenzene.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C9H7Cl/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,8H2.

What is the InChIKey of the compound?

The InChIKey of the compound is RMPSZEZJKSUNKR-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is C1=CC=C(C=C1)C#CCCl.

What is the CAS number of the compound?

The CAS number of the compound is 3355-31-5.

What is the European Community (EC) number of the compound?

The European Community (EC) number of the compound is 628-693-0.

What is the DSSTox Substance ID of the compound?

The DSSTox Substance ID of the compound is DTXSID20955184.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is 2.7.