3,4-Difluorobenzenesulfonyl chloride

• Catalog Number: ACM145758050
• Product Name: 3,4-Difluorobenzenesulfonyl chloride
• CAS: 145758-05-0
• Category: Aryl Fluorinated Building Blocks
• Synonyms: 555916_ALDRICH, 3,4-Difluorobenzenesulfonyl chloride, ALBB-000990, ALD-N000078, JRD-1791, 3,4-Difluorobenzenesulphonyl chloride, 145758-05-0
• IUPAC Name: 3,4-difluorobenzenesulfonyl chloride
• Molecular Weight: 212.60
• Molecular Formula: C₆H₃ClF₂O₂S
• Canonical SMILES: C1=CC(=C(C=C1S(=O)(=O)Cl)F)F
• InChI Key: FSGLUBQENACWCC-UHFFFAOYSA-N
• Boiling Point: 105ºC (15 torr)
• Flash Point: 109.9ºC
• Density: 1.586
• Exact Mass: 211.95100
• Hazard Statements: H315-H319
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Packing Group: II
• RIDADR: NONH for all modes of transport
• Safety Description: S26-S36/37/39-S45
• Symbol: GHS07
• WGK Germany: 3

Custom Q&A

What is the molecular formula of 3,4-Difluorobenzenesulfonyl chloride?

The molecular formula is C6H3ClF2O2S.

What is the molecular weight of 3,4-Difluorobenzenesulfonyl chloride?

The molecular weight is 212.60 g/mol.

What is the IUPAC name of 3,4-Difluorobenzenesulfonyl chloride?

The IUPAC name is 3,4-difluorobenzenesulfonyl chloride.

What is the InChIKey of 3,4-Difluorobenzenesulfonyl chloride?

The InChIKey is FSGLUBQENACWCC-UHFFFAOYSA-N.

What is the Canonical SMILES of 3,4-Difluorobenzenesulfonyl chloride?

The Canonical SMILES is C1=CC(=C(C=C1S(=O)(=O)Cl)F)F.

What is the CAS number of 3,4-Difluorobenzenesulfonyl chloride?

The CAS number is 145758-05-0.

How many hydrogen bond acceptor counts are there in 3,4-Difluorobenzenesulfonyl chloride?

There are 4 hydrogen bond acceptor counts.

What is the topological polar surface area of 3,4-Difluorobenzenesulfonyl chloride?

The topological polar surface area is 42.5 Å2.

How many heavy atoms are there in the molecule of 3,4-Difluorobenzenesulfonyl chloride?

There are 12 heavy atoms.

Is the compound canonicalized?

Yes, the compound is canonicalized.