Structure

2,6-Difluorobenzenesulfonyl chloride

CAS
60230-36-6
Catalog Number
ACM60230366
Category
Aryl Fluorinated Building Blocks
Molecular Weight
212.60
Molecular Formula
C6H2BrF3

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Specification

Hazard Statements
H314
RIDADR
NONH for all modes of transport
Symbol
GHS05
What is the molecular formula of 2,6-Difluorobenzenesulfonyl chloride?

The molecular formula is C6H3ClF2O2S.

When was 2,6-Difluorobenzenesulfonyl chloride created and last modified?

It was created on 2005-07-19 and last modified on 2023-12-23.

What is the IUPAC name of 2,6-Difluorobenzenesulfonyl chloride?

The IUPAC name is 2,6-difluorobenzenesulfonyl chloride.

What is the InChIKey of 2,6-Difluorobenzenesulfonyl chloride?

The InChIKey is QXWAUQMMMIMLTO-UHFFFAOYSA-N.

What is the Canonical SMILES of 2,6-Difluorobenzenesulfonyl chloride?

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

What is the molecular weight of 2,6-Difluorobenzenesulfonyl chloride?

The molecular weight is 212.60 g/mol.

What is the CAS number of 2,6-Difluorobenzenesulfonyl chloride?

The CAS number is 60230-36-6.

How many hydrogen bond acceptors are there in 2,6-Difluorobenzenesulfonyl chloride?

There are 4 hydrogen bond acceptors.

What is the topological polar surface area of 2,6-Difluorobenzenesulfonyl chloride?

The topological polar surface area is 42.5 Å2.

Is 2,6-Difluorobenzenesulfonyl chloride a canonicalized compound?

Yes, it is a canonicalized compound.

Upstream Synthesis Route 1

  • 372-18-9
  • 60230-36-6

Reference: [1] Patent: US2013/53562, 2013, A1, . Location in patent: Paragraph 0073

Downstream Synthesis Route 1

  • 1195768-18-3
  • 60230-36-6
  • 1195768-19-4

Reference: [1] Patent: WO2011/47238, 2011, A1, . Location in patent: Page/Page column 17-18

Downstream Synthesis Route 2

  • 60230-36-6
  • 1195768-23-0

Reference: [1] Patent: WO2011/47238, 2011, A1,

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

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