-
Name
Sodium 3-sulfobenzoate
- EINECS 241-602-5
- CAS No. 17625-03-5
- Density 1.792[at 20℃]
- Solubility 100g/L at 20.5℃
- Melting Point >300 ºC
- Formula C7H4NaO5S
- Boiling Point 365.41℃[at 101 325 Pa]
- Molecular Weight 224.169
- Flash Point
- Transport Information
- Appearance White fine crystalline powder
- Safety 26-36
- Risk Codes 36/37/38
-
Molecular Structure
-
Hazard Symbols
- Synonyms Benzoicacid, 3-sulfo-, monosodium salt (9CI);Benzoic acid, m-sulfo-, monosodium salt(8CI);3-Sulfobenzoic acid sodium salt;Monosodium 3-sulfobenzoate;Monosodiumm-sulfobenzoate;Sodium 3-carboxybenzenesulfonate;Sodium 3-sulfobenzoate;Sodium hydrogen 3-Sulfobenzoate;Sodium m-sulfobenzoate;m-Sulfobenzoic acidmonosodium salt;
- PSA 102.88000
- LogP 1.36970
Sodium 3-sulfobenzoate Chemical Properties
IUPAC Name: Sodium 3-carboxybenzenesulfonate
Following is the structure of Benzoic acid, 3-sulfo-,sodium salt (1:1) (CAS NO.17625-03-5):
Empirical Formula: C7H4NaO5S
Molecular Weight: 223.159
EINECS: 241-602-5
Melting point: ≥300 °C(lit.)
Appearance of Benzoic acid, 3-sulfo-,sodium salt (1:1) (CAS NO.17625-03-5): White fine crystalline powder
Canonical SMILES: C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)O.[Na+]
InChI: InChI=1S/C7H6O5S.Na/c8-7(9)5-2-1-3-6(4-5)13(10,11)12;/h1-4H,(H,8,9)(H,10,11,12);/q;+1/p-1
InChIKey: KQHKITXZJDOIOD-UHFFFAOYSA-M
Sodium 3-sulfobenzoate Toxicity Data With Reference
Benzoic acid, 3-sulfo-,sodium salt (1:1) (CAS NO.17625-03-5) hasn't been listed as a carcinogen by ACGIH, IARC, NTP, or CA Prop 65.
Sodium 3-sulfobenzoate Safety Profile
Hazard Codes: 
Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 3
Sodium 3-sulfobenzoate Specification
Benzoic acid, 3-sulfo-,sodium salt (1:1) , its cas register number 17625-03-5. It also can be called 3-Carboxybenzenesulfonic acid sodium salt ; 3-Sulfobenzoic acid monosodium salt ; 3-SSBA ; and Sodium 3-sulfobenzoate .
Benzoic acid, 3-sulfo-,sodium salt (1:1) (CAS NO.17625-03-5) could be stable under normal temperatures and pressures. It should avoid the condition like Strong oxidants. And also prevent it to broken down into hazardous decomposition products: Irritating and toxic fumes and gases.
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