3-Chloro-2-fluorobenzenesulfonyl chloride

• CAS: 351003-48-0
• Catalog Number: ACM351003480
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 229.06
• Molecular Formula: C₆H₃O₂Cl₂FS
• Synonyms: 3-Chloro-2-fluorobenzenesulfonyl chloride, 351003-48-0, 3-Chloro-2-fluorobenzenesulphonyl chloride, 3-chloro-2-fluorobenzene-1-sulfonyl chloride, SBB066552, AG-F-20776, 3-chloro-2-fluorobenzenesulphonylchloride, PubChem8446, ACMC-209vns, AC1MCT15, AC1Q4L3O, KSC222A3D, 558672_ALDRICH, CTK1C2031, MolPort-000-152-947, ACT01235, ANW-45302, WT1864, AKOS009159510, AM62503
• IUPAC Name: 3-chloro-2-fluorobenzenesulfonyl chloride
• Canonical SMILES: C1=CC(=C(C(=C1)Cl)F)S(=O)(=O)Cl
• InChI Key: LIRQNYQIFFLGIE-UHFFFAOYSA-N
• Boiling Point: 287.2ºC at 760mmHg
• Flash Point: 127.5ºC
• Density: 1.584
• Exact Mass: 227.92100
• Hazard Statements: H302 + H312 + H332-H315-H319-H335
• H-Bond Acceptor: 3
• H-Bond Donor: 0
• Packing Group: II
• RIDADR: UN 2920 3(8) / PGII
• Safety Description: 26-36/37/39-45
• Symbol: GHS07
• WGK Germany: 3

Custom Q&A

What is the molecular formula of 3-Chloro-2-fluorobenzenesulfonyl chloride?

The molecular formula of 3-Chloro-2-fluorobenzenesulfonyl chloride is C6H3Cl2FO2S.

What is the molecular weight of 3-Chloro-2-fluorobenzenesulfonyl chloride?

The molecular weight of 3-Chloro-2-fluorobenzenesulfonyl chloride is 229.06 g/mol.

What are some synonyms for 3-Chloro-2-fluorobenzenesulfonyl chloride?

Some synonyms for 3-Chloro-2-fluorobenzenesulfonyl chloride are 3-Chloro-2-fluorobenzenesulphonyl chloride, 3-chloro-2-fluorobenzene-1-sulfonyl chloride, and 3-chloro-2-fluorophenylsulfonyl chloride.

When was 3-Chloro-2-fluorobenzenesulfonyl chloride first created?

3-Chloro-2-fluorobenzenesulfonyl chloride was first created on July 19, 2005.

What is the InChIKey of 3-Chloro-2-fluorobenzenesulfonyl chloride?

The InChIKey of 3-Chloro-2-fluorobenzenesulfonyl chloride is LIRQNYQIFFLGIE-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 3-Chloro-2-fluorobenzenesulfonyl chloride have?

3-Chloro-2-fluorobenzenesulfonyl chloride has 0 hydrogen bond donor counts.

What is the exact mass of 3-Chloro-2-fluorobenzenesulfonyl chloride?

The exact mass of 3-Chloro-2-fluorobenzenesulfonyl chloride is 227.9214841 g/mol.

How many hydrogen bond acceptor counts does 3-Chloro-2-fluorobenzenesulfonyl chloride have?

3-Chloro-2-fluorobenzenesulfonyl chloride has 3 hydrogen bond acceptor counts.

What is the topological polar surface area of 3-Chloro-2-fluorobenzenesulfonyl chloride?

The topological polar surface area of 3-Chloro-2-fluorobenzenesulfonyl chloride is 42.5 Ų.

Is 3-Chloro-2-fluorobenzenesulfonyl chloride a canonicalized compound?

Yes, 3-Chloro-2-fluorobenzenesulfonyl chloride is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 2106-04-9

• 351003-48-0

Reference: [1] Journal of Medicinal Chemistry, 2014, vol. 57, # 22, p. 9539 - 9553