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98-67-9

Basic Information
CAS No.: 98-67-9
Name: 4-Hydroxybenzenesulfonic acid
Article Data: 69
Molecular Structure:
Molecular Structure of 98-67-9 (4-Hydroxybenzenesulfonic acid)
Formula: C6H6O4S
Molecular Weight: 174.177
Synonyms: Benzenesulfonicacid, p-hydroxy- (8CI);Benzenesulfonic acid,4-hydroxy-;4-Hydroxyphenylsulfonicacid;4-Phenolsulfonic acid;NSC 227908;p-Hydroxybenzenesulfonic acid;p-Phenolsulfonic acid;p-Sulfophenol;phenol sulfonic acid;4-Hydroxyphenylsulfonic acid;
EINECS: 202-691-6
Density: 1.574 g/cm3
Melting Point: 50(分解)oC
Boiling Point: 275.14°C (rough estimate)
Solubility: Soluble in water.
Appearance: yellowish oily liquid
Hazard Symbols: CorrosiveC
Risk Codes: 34
Safety: 26-36/37/39-45
Transport Information: UN 2586 8/PG 3
PSA: 82.98000
LogP: 1.71970
Synthetic route
64-17-5

ethanol

391859-81-7

2-hydroxy-5-sulfo-benzenediazonium-betaine

98-67-9

p-hydoroxybenzenesulfonic acid

2154-66-7

4-sulfobenzenediazonium

98-67-9

p-hydoroxybenzenesulfonic acid

Conditions
ConditionsYield
With water
305-80-6

4-diazobenzenesulfonic acid

98-67-9

p-hydoroxybenzenesulfonic acid

Conditions
ConditionsYield
Geschwindigkeit der Zersetzung bei Ultraviolett-Bestrahlung zwischen pH 1und 10 und Temperaturen zwischen 35grad und 100grad;
98-66-8

4-chloro-benzenesulfonic acid

98-67-9

p-hydoroxybenzenesulfonic acid

Conditions
ConditionsYield
With sodium hydroxide at 300℃;
With quicklime; water; copper at 180 - 200℃;
With barium dihydroxide; water; copper at 180 - 200℃;
With quicklime; water at 180 - 200℃; in Gegenwart von Kupferverbindungen;
With barium dihydroxide; water at 180 - 200℃; in Gegenwart von Kupferverbindungen;
138-36-3

p-bromobenzene sulfonic acid

98-67-9

p-hydoroxybenzenesulfonic acid

Conditions
ConditionsYield
With quicklime; water; copper at 180 - 200℃;
With barium dihydroxide; water; copper at 180 - 200℃;
With quicklime; water at 180 - 200℃; in Gegenwart von Kupferverbindungen;
With barium dihydroxide; water at 180 - 200℃; in Gegenwart von Kupferverbindungen;
25117-74-2

4-ethoxybenzonitrile

98-67-9

p-hydoroxybenzenesulfonic acid

Conditions
ConditionsYield
With sulfuric acid
609-46-1

phenol-2-sulfonic acid

98-67-9

p-hydoroxybenzenesulfonic acid

Conditions
ConditionsYield
With sulfuric acid
5857-93-2

2-amino-4-hydroxy-benzenesulfonic acid

98-67-9

p-hydoroxybenzenesulfonic acid

Conditions
ConditionsYield
Erhitzen der entstandenen Diazoverbindung mit Alkohol und Kupferpulver.Diazotization;
156570-57-9

6.4'-Dioxy-3-methyl-diphenylsulfon

A

98-67-9

p-hydoroxybenzenesulfonic acid

B

7134-06-7

4-hydroxy-toluene-3-sulfonic acid

Conditions
ConditionsYield
With sulfuric acid
118-55-8

phenyl Salicylate

98-67-9

p-hydoroxybenzenesulfonic acid

Conditions
ConditionsYield
With sulfuric acid
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Chemistry

IUPAC: 4-Hydroxybenzenesulfonic acid
Molecular Formula: C6H6O4S
Molecular Weight: 174.17 g/mol
Density: 1.337 g/mL at 25 °C
Refractive Index: n20/D 1.489
Stability: Stable. Combustible. Incompatible with strong oxidizing agents. 
Molar Refractivity: 38.63 cm3
Molar Volume: 110.6 cm3
Polarizability: 15.31×10-24 cm3
Surface Tension: 66.1 dyne/cm
The structure of 4-Hydroxyphenylsulfonic acid (CAS NO.98-67-9):

XLogP3: 0.2
H-Bond Donor: 2
H-Bond Acceptor: 4
Rotatable Bond Count: 1
Tautomer Count: 2
Exact Mass: 173.998679
MonoIsotopic Mass: 173.998679
Topological Polar Surface Area: 74.6
Heavy Atom Count: 11 
Canonical SMILES: C1=CC(=CC=C1O)S(=O)(=O)O
InChI: InChI=1S/C6H6O4S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4,7H,(H,8,9,10)
InChIKey: FEPBITJSIHRMRT-UHFFFAOYSA-N
EINECS: 202-691-6
Product Categories: Intermediates of Dyes and Pigments;Organic acids

Uses

 4-Hydroxyphenylsulfonic acid (CAS NO.98-67-9) is mainly used for the resin cure. It is also used as a casting resin curing agent at room temperature.

Toxicity Data With Reference

1.    

orl-mus LD50:6400 mg/kg

    JAFCAU    Journal of Agricultural and Food Chemistry. 15 (1967),845.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Mildly toxic by ingestion. When heated to decomposition it emits toxic vapors of SOx.
Hazard Codes: C
Risk Statements: 34
34: Causes burns
Safety Statements: 26-36/37/39-45 
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
36/37/39: Wear suitable protective clothing, gloves and eye/face protection 
45: In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
RIDADR: UN 2586 8/PG 3
RTECS: DB6970000
HazardClass: 8
PackingGroup: III

Specification

 4-Hydroxyphenylsulfonic acid (CAS NO.98-67-9) is also named as 4-11-00-00582 (Beilstein Handbook Reference) ; 4-Hydroxybenzenesulfonic acid ; 4-Phenolsulfonic acid ; BRN 1869034 ; Benzenesulfonic acid, 4-hydroxy- ; Benzenesulfonic acid, p-hydroxy- ; HSDB 5319 ; NSC 227908 ; Sulfocarbolic acid ; p-Hydroxybenzenesulfonic acid ; p-Phenolsulfonic acid ; p-Sulfophenol . 4-Hydroxyphenylsulfonic acid (CAS NO.98-67-9) is yellowish oily liquid.