2,5-Difluorophenyl isothiocyanate

• CAS: 206559-57-1
• Catalog Number: ACM206559571
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 171.17
• Hazard Statements: H302 + H312 + H332-H315-H319-H335
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 2,5-Difluorophenyl isothiocyanate?

The molecular formula is C7H3F2NS.

What is the molecular weight of 2,5-Difluorophenyl isothiocyanate?

The molecular weight is 171.17 g/mol.

What is the IUPAC name of 2,5-Difluorophenyl isothiocyanate?

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

What is the InChI of 2,5-Difluorophenyl isothiocyanate?

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

What is the InChIKey of 2,5-Difluorophenyl isothiocyanate?

The InChIKey is QVIDXDRFMDPVLA-UHFFFAOYSA-N.

What is the Canonical SMILES of 2,5-Difluorophenyl isothiocyanate?

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

What is the CAS number of 2,5-Difluorophenyl isothiocyanate?

The CAS number is 206559-57-1.

What is the European Community (EC) Number of 2,5-Difluorophenyl isothiocyanate?

The European Community (EC) Number is 623-660-7.

What is the XLogP3-AA value of 2,5-Difluorophenyl isothiocyanate?

The XLogP3-AA value is 3.5.

Is 2,5-Difluorophenyl isothiocyanate a canonicalized compound?

Yes, it is a canonicalized compound.