2,4-Difluorophenyl isothiocyanate

• CAS: 141106-52-7
• Catalog Number: ACM141106527
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 171.17
• Hazard Statements: H302 + H312 + H332-H315-H319-H335
• RIDADR: UN 3080PSN1 3(6.1) / PGII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 2,4-Difluorophenyl isothiocyanate?

The molecular formula is C7H3F2NS.

What is the molecular weight of 2,4-Difluorophenyl isothiocyanate?

The molecular weight is 171.17 g/mol.

What is the IUPAC Name of 2,4-Difluorophenyl isothiocyanate?

The IUPAC Name is 2,4-difluoro-1-isothiocyanatobenzene.

What is the InChI of 2,4-Difluorophenyl isothiocyanate?

The InChI is InChI=1S/C7H3F2NS/c8-5-1-2-7(10-4-11)6(9)3-5/h1-3H.

What is the InChIKey of 2,4-Difluorophenyl isothiocyanate?

The InChIKey is ABGGPKIFVAIRGU-UHFFFAOYSA-N.

What is the Canonical SMILES of 2,4-Difluorophenyl isothiocyanate?

The Canonical SMILES is C1=CC(=C(C=C1F)F)N=C=S.

What is the CAS number of 2,4-Difluorophenyl isothiocyanate?

The CAS number is 141106-52-7.

What is the European Community (EC) Number of 2,4-Difluorophenyl isothiocyanate?

The European Community (EC) Number is 624-035-1.

What is the XLogP3-AA value of 2,4-Difluorophenyl isothiocyanate?

The XLogP3-AA value is 3.5.

Is the compound canonicalized?

Yes, the compound is canonicalized.

Synthetic Use

Downstream Synthesis Route 1

• 115551-33-2
• 141106-52-7

• 371914-71-5

Reference: [1]Journal of Fluorine Chemistry,2004,vol. 125,p. 1609 - 1620

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