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86456-22-6

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Basic Information
CAS No.: 86456-22-6
Name: 8-{[2-(dimethylamino)ethyl]amino}-5-(hydroxymethyl)-9-oxo-9H-xanthen-2-yl 4-methylbenzenesulfonate
Article Data: 2
Molecular Structure:
Molecular Structure of 86456-22-6 (8-{[2-(dimethylamino)ethyl]amino}-5-(hydroxymethyl)-9-oxo-9H-xanthen-2-yl 4-methylbenzenesulfonate)
Formula: C25H26N2O6S
Molecular Weight: 482.557
Density: 1.364g/cm3
Boiling Point: 705.7°C at 760 mmHg
Flash Point: 380.6°C
PSA: 117.46000
LogP: 4.64190
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Synthetic route
50-00-0

formaldehyd

86456-20-4

1-<<2-(dimethylamino)ethyl>amino>-7-(toluenesulfonyloxy)-9H-xanthen-9-one

86456-22-6

NSC 354677

Conditions
ConditionsYield
With acetic acid at 70℃; for 72h;46%
625-99-0

3-iodochlorobenzene

86456-22-6

NSC 354677

Conditions
ConditionsYield
Multi-step reaction with 5 steps
1: 1.) K2CO3, 2.) Cu, CuI / 1.) DMF, 120 deg C, 10 min, 2.) DMF, reflux, 50 h
2: 1.) 50percent polyphosphoric acid, 2.) pyridine / 1.) 120 deg C, 3 h, 2.) reflux, 16 h
3: 87 percent / 56percent HI / 4 h / Heating
4: 92 percent / pyridine / 1.5 h / 50 °C
5: 46 percent / 5 N aq. acetic acid / 72 h / 70 °C
View Scheme
2612-02-4

5-methoxysalicylic acid

86456-22-6

NSC 354677

Conditions
ConditionsYield
Multi-step reaction with 5 steps
1: 1.) K2CO3, 2.) Cu, CuI / 1.) DMF, 120 deg C, 10 min, 2.) DMF, reflux, 50 h
2: 1.) 50percent polyphosphoric acid, 2.) pyridine / 1.) 120 deg C, 3 h, 2.) reflux, 16 h
3: 87 percent / 56percent HI / 4 h / Heating
4: 92 percent / pyridine / 1.5 h / 50 °C
5: 46 percent / 5 N aq. acetic acid / 72 h / 70 °C
View Scheme
86456-12-4

2-(3-chlorophenoxy)-5-methoxybenzoic acid

86456-22-6

NSC 354677

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1: 1.) 50percent polyphosphoric acid, 2.) pyridine / 1.) 120 deg C, 3 h, 2.) reflux, 16 h
2: 87 percent / 56percent HI / 4 h / Heating
3: 92 percent / pyridine / 1.5 h / 50 °C
4: 46 percent / 5 N aq. acetic acid / 72 h / 70 °C
View Scheme
86456-18-0

1-<<2-(dimethylamino)ethyl>amino>-7-hydroxy-9H-xanthen-9-one

86456-22-6

NSC 354677

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 92 percent / pyridine / 1.5 h / 50 °C
2: 46 percent / 5 N aq. acetic acid / 72 h / 70 °C
View Scheme
86456-16-8

1-<<2-(dimethylamino)ethyl>amino>-7-methoxy-9H-xanthen-9-one

86456-22-6

NSC 354677

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: 87 percent / 56percent HI / 4 h / Heating
2: 92 percent / pyridine / 1.5 h / 50 °C
3: 46 percent / 5 N aq. acetic acid / 72 h / 70 °C
View Scheme
86456-22-6

NSC 354677

86455-98-3

1-[[2-(Dimethylamino)ethyl]amino]-7-hydroxy-4-(hydroxymethyl)-9H-xanthen-9-one

Conditions
ConditionsYield
With potassium hydroxide In ethanol for 0.5h; Heating;88%
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