Sodium 3-sulfobenzoate

• CAS: 17625-03-5
• Catalog Number: ACM17625035
• Category: Other Products
• Molecular Weight: 224.17
• Molecular Formula: NaO3SC6H4CO2H
• Synonyms: 3-Carboxybenzenesulfonic acid sodium salt,3-Sulfobenzoic acid sodium salt
• Melting Point: ≥300°C(lit.)
• Hazard Statements: Xi
• MDL Number: MFCD00066378
• Safety Description: 26-36
• Supplemental Hazard Statements: H315-H319-H335
• Symbol: GHS07

Custom Q&A

What is the molecular formula of Sodium 3-sulfobenzoate?

The molecular formula of Sodium 3-sulfobenzoate is C7H5NaO5S.

When was Sodium 3-sulfobenzoate initially created on PubChem?

Sodium 3-sulfobenzoate was created on February 5, 2008.

What is the molecular weight of Sodium 3-sulfobenzoate?

The molecular weight of Sodium 3-sulfobenzoate is 224.17 g/mol.

What are the synonyms for Sodium 3-sulfobenzoate?

Some synonyms for Sodium 3-sulfobenzoate include Sodium 3-sulfobenzoate, 17625-03-5, and Benzoic acid, 3-sulfo-, monosodium salt.

What is the InChIKey for Sodium 3-sulfobenzoate?

The InChIKey for Sodium 3-sulfobenzoate is KQHKITXZJDOIOD-UHFFFAOYSA-M.

What is the topological polar surface area of Sodium 3-sulfobenzoate?

The topological polar surface area of Sodium 3-sulfobenzoate is 103 Å^2.

How many hydrogen bond donor counts does Sodium 3-sulfobenzoate have?

Sodium 3-sulfobenzoate has 1 hydrogen bond donor count.

Is Sodium 3-sulfobenzoate a covalently-bonded unit?

Yes, Sodium 3-sulfobenzoate is a covalently-bonded unit.

How many heavy atoms are in the structure of Sodium 3-sulfobenzoate?

The structure of Sodium 3-sulfobenzoate contains 14 heavy atoms.

What is the formal charge of Sodium 3-sulfobenzoate?

The formal charge of Sodium 3-sulfobenzoate is 0.

Synthetic Use

Downstream Synthesis Route 1

• 17625-03-5

• 63555-50-0

Reference: [1] European Journal of Medicinal Chemistry, 2018, vol. 150, p. 282 - 291

Downstream Synthesis Route 2

• 17625-03-5

• 414864-00-9

Reference: [1] Patent: CN104478769, 2016, B,

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