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1,3,6-Naphthalenetrisulfonicacid, 7-hydroxy-

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Name

1,3,6-Naphthalenetrisulfonicacid, 7-hydroxy-

EINECS 228-407-0
CAS No. 6259-66-1 Density 2.019 g/cm3
PSA 208.48000 LogP 3.52790
Solubility N/A Melting Point N/A
Formula C10H8O10S3 Boiling Point N/A
Molecular Weight 384.366 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 6259-66-1 (2,NAPHTHOL-3,6,8-TRISULFONIC ACID) Hazard Symbols N/A
Synonyms

2-Hydroxy-3,6,8-naphthalenetrisulfonicacid;2-Naphthol-3,6,8-trisulfonic acid;7-Hydroxy-1,3,6-naphthalenetrisulfonicacid;

Article Data 8

1,3,6-Naphthalenetrisulfonicacid, 7-hydroxy- Synthetic route

7-ethoxycarbonyloxy-naphthalene-1,3,6-trisulfonic acid ; potassium salt

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

Conditions
ConditionsYield
beim Trocknen;
135-19-3

β-naphthol

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

Conditions
ConditionsYield
With sulfuric acid at 70 - 80℃; man gibt noch H2SO4 hinzu und erhitzt laengere Zeit auf 120grad; endlich fuegt man rauchende Schwefelsaeure (mit 40prozent SO3) hinzu und erwaermt laengere Zeit auf 150grad;
With sulfuric acid; sulfur trioxide at 140 - 160℃; das Reaktionsprodukts verarbeitet man dann in der ueblichen Weise auf das Natriumsalz;
With sulfuric acid at 70 - 80℃; man gibt noch H2SO4 hinzu und erhitzt laengere Zeit auf 120grad; endlich fuegt man rauchende Schwefelsaeure (mit 40prozent SO3) hinzu und erwaermt laengere Zeit auf 150grad;
With sulfuric acid; sulfur trioxide at 140 - 160℃; das Reaktionsprodukts verarbeitet man dann in der ueblichen Weise auf das Natriumsalz;

2,2-dioxo-2λ6-naphth[2,3-c][1,2]oxathiete-5,7-disulfonic acid

diluted NaOH-solution

diluted NaOH-solution

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

7664-93-9

sulfuric acid

135-19-3

β-naphthol

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

Conditions
ConditionsYield
at 140 - 160℃;
at 140 - 160℃;
3-hydroxy-naphthalene-disulfonic acid-(2.7)

3-hydroxy-naphthalene-disulfonic acid-(2.7)

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

Conditions
ConditionsYield
With sulfuric acid at 175℃;
7-hydroxy-naphthalene-disulfonic acid-(1.3)

7-hydroxy-naphthalene-disulfonic acid-(1.3)

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

Conditions
ConditionsYield
With sulfuric acid at 175℃;

7-ethoxycarbonyloxy-naphthalene-1,3,6-trisulfonic acid ; potassium salt

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

Conditions
ConditionsYield
beim Aufbewahren;
856210-17-8

7-ethoxycarbonyloxy-naphthalene-1,3,6-trisulfonyl chloride

alcoholic alkaline solution

alcoholic alkaline solution

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

856210-17-8

7-ethoxycarbonyloxy-naphthalene-1,3,6-trisulfonyl chloride

aqueous alkaline solution

aqueous alkaline solution

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

67-66-3

chloroform

6259-66-1

7-hydroxy-naphthalene-1,3,6-trisulfonic acid

8-formyl-7-hydroxy-naphthalene-1,3,6-trisulfonic acid

Conditions
ConditionsYield
With sodium hydroxide

1,3,6-Naphthalenetrisulfonicacid, 7-hydroxy- Specification

The 1,3,6-Naphthalenetrisulfonicacid, 7-hydroxy-, with the CAS registry number 6259-66-1, is also known as 2-Naphthol-3,6,8-trisulfonic acid. Its EINECS number is 228-407-0. This chemical's molecular formula is C10H8O10S3 and molecular weight is 384.36. What's more, its systematic name is 7-Hydroxynaphthalene-1,3,6-trisulfonic acid. 

Physical properties of 1,3,6-Naphthalenetrisulfonicacid, 7-hydroxy- are: (1)ACD/LogP: -0.62; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -6.12; (4)ACD/LogD (pH 7.4): -6.14; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 10; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 164.48 Å2; (13)Index of Refraction: 1.741; (14)Molar Refractivity: 76.88 cm3; (15)Molar Volume: 190.3 cm3; (16)Polarizability: 30.48×10-24cm3; (17)Surface Tension: 105.6 dyne/cm; (18)Density: 2.019 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)c1c2c(cc(c1)S(=O)(=O)O)cc(c(O)c2)S(=O)(=O)O
(2)InChI: InChI=1S/C10H8O10S3/c11-8-4-7-5(2-10(8)23(18,19)20)1-6(21(12,13)14)3-9(7)22(15,16)17/h1-4,11H,(H,12,13,14)(H,15,16,17)(H,18,19,20)
(3)InChIKey: ANYNWDCUWOSEFH-UHFFFAOYSA-N

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