Basic information
- Name:
Sodium 4-hydroxybenzenesulfonate
- CAS No.:
825-90-1
- Molecular Structure:
- Formula:
- C6H5NaO4S
- Molecular Weight:
- 196.1563
- Synonyms:
- Benzenesulfonicacid, 4-hydroxy-, monosodium salt (9CI);Benzenesulfonic acid, p-hydroxy-,monosodium salt (8CI);4-Hydroxybenzenesulfonic acid sodium salt;Benzenesulfonic acid,4-hydroxy-, sodium salt (1:1);Sodium p-hydroxybenzenesulfonate;Sodiump-hydroxyphenylsulfonate;Sodium p-phenolsulfonate;p-Hydroxybenzenesulfonicacid monosodium salt;p-Hydroxybenzenesulfonic acid sodium salt;p-Phenolsulfonic acid sodium salt;
- EINECS:
- 212-550-0
- Melting Point:
- >300 °C
- Risk Codes:
- 36/37/38
- Safety Description:
- 26-37/39 Details
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Chemistry
Molecule structure of Sodium 4-hydroxybenzenesulfonate (CAS NO.825-90-1):
IUPAC Name: Sodium 4-hydroxybenzenesulfonate
Molecular Weight: 196.15627 g/mol
Molecular Formula: C6H5NaO4S
Melting Point: >300 °C
H-Bond Donor: 1
H-Bond Acceptor: 4
Rotatable Bond Count: 1
Tautomer Count: 2
Exact Mass: 195.980624
MonoIsotopic Mass: 195.980624
Topological Polar Surface Area: 77.4
Heavy Atom Count: 12
Canonical SMILES: C1=CC(=CC=C1O)S(=O)(=O)[O-].[Na+]
InChI: InChI=1S/C6H6O4S.Na/c7-5-1-3-6(4-2-5)11(8,9)10;/h1-4,7H,(H,8,9,10);/q;+1/p-1
InChIKey: BYMHXIQVEAYSJD-UHFFFAOYSA-M
EINECS of Sodium 4-hydroxybenzenesulfonate (CAS NO.825-90-1): 212-550-0
Safety Profile
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S37/39:Wear suitable gloves and eye/face protection.
Specification
Sodium 4-hydroxybenzenesulfonate (CAS NO.825-90-1) is also named as 4-Hydroxybenzenesulfonic acid, monosodium salt ; Monosodium 4-phenolsulfonate ; NSC 147483 ; Sodium p-hydroxybenzenesulfonate ; Sodium p-hydroxyphenylsulfonate ; p-Hydroxybenzenesulfonic acid, monosodium salt ; Benzenesulfonic acid, 4-hydroxy-, monosodium salt ; Benzenesulfonic acid, 4-hydroxy-, sodium salt (1:1) .