2-(2-Bromophenyl)-1,3-dioxolane

• CAS: 34824-58-3
• Catalog Number: ACM34824583
• Category: Bromine Series
• Molecular Weight: 229.07
• Molecular Formula: C9H9BrO2
• Synonyms: 2-(2-Bromophenyl)-1,3-dioxolane, 34824-58-3, 2-Bromobenzaldehyde ethylene acetal, 1,3-Dioxolane, 2-(2-bromophenyl)-, SBB067486, AG-F-19508, 1-bromo-2-(1,3-dioxolan-2-yl)benzene, ZINC02530752, PubChem3729, ACMC-1CSYY, AC1LB8VT, SureCN252280, AC1Q26DX, 652652_ALDRICH, AC1Q255P, RARECHEM AL BP 0014, CTK4H3086, ATTERCOP-CHM AT108947, MolPort-001-768-368, ANW-27980
• IUPAC Name: 2-(2-bromophenyl)-1,3-dioxolane
• InChI Key: IWSGKSUCFVOWQU-UHFFFAOYSA-N
• Boiling Point: 272.1ºC at 760mmHg
• Flash Point: 120.8ºC
• Density: 1.515g/cm³
• Appearance: Clear colorless to pale yellow liquid
• Exact Mass: 227.97900
• Hazard Statements: H226-H315-H319-H335
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• RIDADR: NONH for all modes of transport
• Safety Description: S24/25
• Symbol: GHS02
• WGK Germany: 2

Custom Q&A

What is the molecular formula of 2-(2-Bromophenyl)-1,3-dioxolane?

The molecular formula of 2-(2-Bromophenyl)-1,3-dioxolane is C9H9BrO2.

What is the molecular weight of 2-(2-Bromophenyl)-1,3-dioxolane?

The molecular weight of 2-(2-Bromophenyl)-1,3-dioxolane is 229.07 g/mol.

When was the structure of 2-(2-Bromophenyl)-1,3-dioxolane created?

The structure was created on 2005-03-27.

What is the IUPAC name of 2-(2-Bromophenyl)-1,3-dioxolane?

The IUPAC name of 2-(2-Bromophenyl)-1,3-dioxolane is 2-(2-bromophenyl)-1,3-dioxolane.

What is the Canonical SMILES notation of 2-(2-Bromophenyl)-1,3-dioxolane?

The Canonical SMILES notation is C1COC(O1)C2=CC=CC=C2Br.

How many hydrogen bond acceptors are there in 2-(2-Bromophenyl)-1,3-dioxolane?

There are 2 hydrogen bond acceptors in 2-(2-Bromophenyl)-1,3-dioxolane.

What is the exact mass of 2-(2-Bromophenyl)-1,3-dioxolane?

The exact mass is 227.97859 g/mol.

How many rotatable bonds are present in 2-(2-Bromophenyl)-1,3-dioxolane?

There is 1 rotatable bond in 2-(2-Bromophenyl)-1,3-dioxolane.

Is 2-(2-Bromophenyl)-1,3-dioxolane considered a canonical compound?

Yes, it is considered a canonical compound.

What is the topological polar surface area of 2-(2-Bromophenyl)-1,3-dioxolane?

The topological polar surface area is 18.5Ų.

Synthetic Use

Upstream Synthesis Route 1

• 107-21-1
• 6630-33-7

• 34824-58-3

Reference: [1]Current Patent Assignee: BRISTOL-MYERS SQUIBB CO - US2004/147401, 2004, A1
Location in patent: Page 33

Downstream Synthesis Route 1

• 34824-58-3

• 7651-81-2

Reference: [1] Organic and Biomolecular Chemistry, 2016, vol. 14, # 3, p. 1065 - 1090

Downstream Synthesis Route 2

• 34824-58-3

• 50458-79-2

Reference: [1] Organic Letters, 2018, vol. 20, # 13, p. 4048 - 4051

Downstream Synthesis Route 3

• 34824-58-3

• 27104-73-0

Reference: [1] Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1987, p. 921 - 926
[2] Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1987, p. 921 - 926

Downstream Synthesis Route 4

• 34824-58-3
• 5650-52-2

• 126983-21-9

Reference: [1]Tetrahedron Letters,1989,vol. 30,p. 5203 - 5206

Downstream Synthesis Route 5

• 34824-58-3
• 106-95-6

• 62708-42-3

Reference: [1]Organic Letters,2014,vol. 16,p. 5032 - 5035
[2]Angewandte Chemie - International Edition,2018,vol. 57,p. 800 - 804
Angew. Chem.,2018,vol. 57,p. 800 - 804,5
[3]Angewandte Chemie - International Edition,2015,vol. 54,p. 12492 - 12496
[4]Journal of Organic Chemistry,1985,vol. 50,p. 2427 - 2431
[5]Chemistry - A European Journal,2019,vol. 25,p. 12620 - 12627

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