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117-59-9

Basic Information
CAS No.: 117-59-9
Name: 1-Naphthol-5-sulfonic acid
Article Data: 8
Molecular Structure:
Molecular Structure of 117-59-9 (1-Naphthol-5-sulfonic acid)
Formula: C10H8O4S
Molecular Weight: 224.237
Synonyms: 1-Hydroxy-5-naphthalenesulfonicacid;5-Hydroxy-1-naphthalenesulfonic acid;C.I.14820;L Acid;a-Naphthol-5-sulfonicacid;
EINECS: 204-199-7
Density: 1.549 g/cm3
Melting Point: 110~112 °C
Solubility: soluble in water
Appearance: off-white to reddish paste
Hazard Symbols: Xn
Risk Codes: R22; R36/37/38
PSA: 82.98000
LogP: 2.87290
Synthetic route
84-89-9

1-aminonaphthalene-5-sulfonic acid

furan-2,3,5(4H)-trione pyridine (1:1)

A

83-55-6

5-amino-1-naphthol

B

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

C

83-56-7

1,5-dihydroxynaphthalene

D

134-32-7

1-amino-naphthalene

Conditions
ConditionsYield
at 220 - 300℃; im Autoklaven;
84-89-9

1-aminonaphthalene-5-sulfonic acid

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

Conditions
ConditionsYield
With water; sodium hydrogensulfite at 100℃;
89108-43-0

5-chloronaphthalene-1-sulfonic acid

furan-2,3,5(4H)-trione pyridine (1:1)

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

Conditions
ConditionsYield
at 240 - 250℃; unter Druck;
81-04-9

naphthalene-1,5-disulfonate

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

Conditions
ConditionsYield
With sodium hydroxide at 160 - 190℃; durch Verschmelzen;
417712-00-6

5-oxo-5,6,7,8-tetrahydro-naphthalene-1,7-disulfonic acid

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

Conditions
ConditionsYield
With hydroxide
81-04-9

naphthalene-1,5-disulfonate

alkalies

alkalies

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

Conditions
ConditionsYield
at 160 - 190℃;
diazotized naphthylamine-(1)-sulfonic acid-(5)

diazotized naphthylamine-(1)-sulfonic acid-(5)

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

Conditions
ConditionsYield
With sulfuric acid
disodium-

disodium-

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

Conditions
ConditionsYield
With sodium hydroxide; water at 260℃;
sodium salt of/the/ 1-chloro-naphthalene-sulfonic acid-(5)

sodium salt of/the/ 1-chloro-naphthalene-sulfonic acid-(5)

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

Conditions
ConditionsYield
With sodium hydroxide at 240 - 250℃;
7664-93-9

sulfuric acid

171290-14-5

5-sulfo-naphthalene-1-diazonium-betaine

117-59-9

1-hydroxynaphthalene-5-sulphonic acid

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Specification

The 1-Naphthol-5-sulfonic acid, with the CAS registry number 117-59-9, is also known as 1-Hydroxy-5-naphthalenesulfonicacid. It belongs to the product category of Intermediates of Dyes and Pigments. Its EINECS number is 204-199-7. This chemical's molecular formula is C10H8O4S and molecular weight is 224.23. What's more, its systematic name is 5-Hydroxy-1-naphthalenesulfonic acid. This chemical should be sealed and stored in a cool, ventilated and dry place. Moreover, it should be protected from heat and moisture. It is used to prepare dyes and organic pigments, and it is also used to prepare sensitiser 215 of photoresist. The product is the intermediate of the direct dyes and organic pigments.

Physical properties of 1-Naphthol-5-sulfonic acid are: (1)ACD/LogP: -0.007; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.50; (4)ACD/LogD (pH 7.4): -3.52; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 82.98 Å2; (13)Index of Refraction: 1.704; (14)Molar Refractivity: 56.188 cm3; (15)Molar Volume: 144.756 cm3; (16)Polarizability: 22.275×10-24cm3; (17)Surface Tension: 71.13 dyne/cm; (18)Density: 1.549 g/cm3.

Preparation: it is a method of addition. Lauren acid (1-amino-5-naphthalene acid) as raw material has an addition reaction with sodium hydrogensulfite aqueous solution in the presence of hydrochloric acid, then the product is got by hydrolysis, acidification and pressure filtration.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)c1cccc2c1cccc2O
(2)Std. InChI: InChI=1S/C10H8O4S/c11-9-5-1-4-8-7(9)3-2-6-10(8)15(12,13)14/h1-6,11H,(H,12,13,14)
(3)Std. InChIKey: YLKCHWCYYNKADS-UHFFFAOYSA-N