4-(Methanesulfonyl)phenylboronic acid pinacol ester

• CAS: 603143-27-7
• Catalog Number: ACM603143277
• Category: Other
• Molecular Weight: 282.16
• Molecular Formula: C₁₃H₁₉BO₄S

Custom Q&A

What is the molecular formula of 4-(Methanesulfonyl)phenylboronic acid pinacol ester?

The molecular formula is C13H19BO4S.

When was this compound created and last modified?

It was created on 2005-07-19 and last modified on 2023-12-02.

What is the molecular weight of this compound?

The molecular weight is 282.2 g/mol.

What is the IUPAC Name of this compound?

The IUPAC Name is 4,4,5,5-tetramethyl-2-(4-methylsulfonylphenyl)-1,3,2-dioxaborolane.

What is the InChIKey of this compound?

The InChIKey is BDOSWBBKOSGKAV-UHFFFAOYSA-N.

How many hydrogen bond acceptors does this compound have?

It has 4 hydrogen bond acceptors.

What is the exact mass of this compound?

The exact mass is 282.1097104 g/mol.

What is the topological polar surface area of this compound?

The topological polar surface area is 61Ų.

How many rotatable bond counts does this compound have?

It has 2 rotatable bond counts.

Is this compound canonicalized?

Yes, the compound is canonicalized.

Synthetic Use

Downstream Synthesis Route 1

• 603143-27-7
• 603143-09-5

• 603143-24-4

Reference: [1]Current Patent Assignee: MERCK & CO INC - US2003/232863, 2003, A1
Location in patent: Page 61

Downstream Synthesis Route 2

• 875339-25-6
• 603143-27-7

• 875339-28-9

Reference: [1]Current Patent Assignee: MIRATI THERAPEUTICS, INC. - WO2006/10264, 2006, A1
Location in patent: Page/Page column 85-86

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