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6-(Dimethylamino)-4-hydroxy-2-naphthalenesulfonic acid

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Name

6-(Dimethylamino)-4-hydroxy-2-naphthalenesulfonic acid

EINECS 228-404-4
CAS No. 6259-50-3 Density 1.463 g/cm3
PSA 86.22000 LogP 2.93890
Solubility N/A Melting Point 251-252 °C (dec.)(lit.)
Formula C12H13NO4S Boiling Point N/A
Molecular Weight 267.306 Flash Point N/A
Transport Information UN 3261 8/PG 2 Appearance N/A
Safety 26-27-28-36/37/39-45 Risk Codes 34
Molecular Structure Molecular Structure of 6259-50-3 (6-DIMETHYLAMINO-4-HYDROXY-2-NAPHTHALENESULFONIC ACID) Hazard Symbols CorrosiveC
Synonyms

6-Dimethylamino-4-hydroxy-2-naphthalenesulfonic acid;NSC 8637;

 

6-(Dimethylamino)-4-hydroxy-2-naphthalenesulfonic acid Synthetic route

90-51-7

6-amino-4-hydroxy-2-naphthalenesulfonic acid

6259-50-3

6-dimethylamino-4-hydroxy-naphthalene-2-sulfonic acid

Conditions
ConditionsYield
durch Methylierung;
118-32-1

2-naphthol-6,8-disulfonic acid

124-40-3

dimethyl amine

6259-50-3

6-dimethylamino-4-hydroxy-naphthalene-2-sulfonic acid

Conditions
ConditionsYield
at 200℃; im Autoklaven und Erhitzen des Produkts mit Aetzalkali auf 210-220grad;

6-(Dimethylamino)-4-hydroxy-2-naphthalenesulfonic acid Specification

The 6-(Dimethylamino)-4-hydroxy-2-naphthalenesulfonic acid, with the CAS registry number 6259-50-3, is also known as 2-Naphthalenesulfonic acid, 6-(dimethylamino)-4-hydroxy-. Its EINECS number is 228-404-4. This chemical's molecular formula is C12H13NO4S and molecular weight is 267.30. What's more, its systematic name is 6-(Dimethylamino)-4-hydroxy-2-naphthalenesulfonic acid. This chemical should be sealed and stored in a cool and dry place. Moreover, it should be protected from oxides.

Physical properties of 6-(Dimethylamino)-4-hydroxy-2-naphthalenesulfonic acid are: (1)ACD/LogP: 0.179; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.96; (4)ACD/LogD (pH 7.4): -3.32; (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: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 86.22 Å2; (13)Index of Refraction: 1.683; (14)Molar Refractivity: 69.323 cm3; (15)Molar Volume: 182.747 cm3; (16)Polarizability: 27.482×10-24cm3; (17)Surface Tension: 68.1 dyne/cm; (18)Density: 1.463 g/cm3.

When you are using this chemical, please be cautious about it as the following:
This chemical can cause burns. You should take off immediately all contaminated clothing. After contact with skin, you must wash immediately with plenty of ... (to be specified by the manufacturer). In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, you should seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)c2cc1ccc(cc1c(O)c2)N(C)C
(2)Std. InChI: InChI=1S/C12H13NO4S/c1-13(2)9-4-3-8-5-10(18(15,16)17)7-12(14)11(8)6-9/h3-7,14H,1-2H3,(H,15,16,17)
(3)Std. InChIKey: LRPIENHBUQIGPP-UHFFFAOYSA-N

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