2-Chlorobenzyl Chloride

• CAS: 611-19-8
• Catalog Number: ACM611198
• Category: Other Products
• Molecular Weight: 161.03
• Molecular Formula: C₉H₁₁I
• Hazard Statements: H315-H318-H335-H410
• RIDADR: UN 2235 6.1 / PGIII
• Symbol: GHS05

Custom Q&A

What is the molecular formula of 2-Chlorobenzyl Chloride?

The molecular formula of 2-Chlorobenzyl Chloride is C7H6Cl2.

What is the molecular weight of 2-Chlorobenzyl Chloride?

The molecular weight of 2-Chlorobenzyl Chloride is 161.03 g/mol.

What is the IUPAC Name of 2-Chlorobenzyl Chloride?

The IUPAC Name of 2-Chlorobenzyl Chloride is 1-chloro-2-(chloromethyl)benzene.

What is the InChIKey of 2-Chlorobenzyl Chloride?

The InChIKey of 2-Chlorobenzyl Chloride is BASMANVIUSSIIM-UHFFFAOYSA-N.

What is the Canonical SMILES of 2-Chlorobenzyl Chloride?

The Canonical SMILES of 2-Chlorobenzyl Chloride is C1=CC=C(C(=C1)CCl)Cl.

What is the CAS number of 2-Chlorobenzyl Chloride?

The CAS number of 2-Chlorobenzyl Chloride is 611-19-8.

What is the XLogP3 value of 2-Chlorobenzyl Chloride?

The XLogP3 value of 2-Chlorobenzyl Chloride is 3.2.

How many hydrogen bond donor counts are in 2-Chlorobenzyl Chloride?

There are 0 hydrogen bond donor counts in 2-Chlorobenzyl Chloride.

What is the topological polar surface area of 2-Chlorobenzyl Chloride?

The topological polar surface area of 2-Chlorobenzyl Chloride is 0-2.

How many rotatable bond counts are in 2-Chlorobenzyl Chloride?

There is 1 rotatable bond count in 2-Chlorobenzyl Chloride.

Synthetic Use

Upstream Synthesis Route 1

• 95-49-8

• 611-19-8

Reference: [1] Green Chemistry, 2018, vol. 20, # 20, p. 4729 - 4737

Upstream Synthesis Route 2

• 81067-96-1

• 5219-70-5
• 611-19-8

Reference: [1] Liebigs Annalen der Chemie, 1982, # 1, p. 121 - 136

Upstream Synthesis Route 3

• 89-98-5

• 56427-98-6
• 611-19-8

Reference: [1] Canadian Journal of Chemistry, 1986, vol. 64, p. 2342 - 2347

Downstream Synthesis Route 1

• 21617-18-5
• 611-19-8

• 97318-74-6

Reference: [1]Surrey et al.
[Journal of the American Chemical Society, 1959, vol. 81, p. 2894,2895]

Downstream Synthesis Route 2

• 6305-95-9
• 611-19-8

• 54673-39-1

Reference: [1]Journal of the American Chemical Society,1959,vol. 81,p. 2894,2895

Downstream Synthesis Route 3

• 54903-50-3
• 611-19-8

• 55142-85-3

Reference: [1]Journal of Organic Chemistry,1957,vol. 22,p. 1338,1341
[2]Patent: GB791350,1958,
Chem.Abstr.,1960,vol. 54

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