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CAS No.: | 119-33-5 |
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Name: | 2-Nitro-p-cresol |
Article Data: | 170 |
Molecular Structure: | |
Formula: | C7H7NO3 |
Molecular Weight: | 153.137 |
Synonyms: | NSC 5387;NSC 66511;o-Nitro-p-methylphenol;p-Cresol,2-nitro- (7CI,8CI);2-Nitro-4-methylphenol;2-Nitro-p-cresol;4-Hydroxy-3-nitrotoluene; |
EINECS: | 204-315-6 |
Density: | 1.32 g/cm3 |
Melting Point: | 32-35 °C(lit.) |
Boiling Point: | 231.1 °C at 760 mmHg |
Flash Point: | 108.3 °C |
Solubility: | slightly soluble in water |
Appearance: | yellow to brownish low melting crystalline mass |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36-45-28A |
Transport Information: | UN 2446 6.1/PG 3 |
PSA: | 66.05000 |
LogP: | 2.13200 |
Conditions | Yield |
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With (NH4)2Ce(NO3)6 on Ca-bentonite In chloroform at 25℃; for 48h; | 98.5% |
With toluene-4-sulfonic acid; nickel(II) nitrate In acetone at 20℃; for 0.0166667h; | 98% |
With dimethylbromosulphonium bromide; tetrabutylammonium nitrite In acetonitrile at 20℃; for 1h; regioselective reaction; | 96% |
Conditions | Yield |
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With acetic anhydride In tetrachloromethane; nitric acid | 98% |
Conditions | Yield |
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With nitro acetate; silica gel In chloroform at -20 - 20℃; Nitration; | A 93% B 6% |
With copper(II) nitrate/zeolite H-Y for 0.0166667h; Product distribution; Further Variations:; heating mode; times; microwave irradiation; | A 88% B n/a |
With tert.-butylnitrite In acetonitrile at 29.84℃; Kinetics; Solvent; Temperature; | A 85% B n/a |
Conditions | Yield |
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With aluminum (III) chloride In dichloromethane at -5 - 25℃; | 93% |
Conditions | Yield |
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With Yb-Mo-modified montmorillonite HKSF; nitric acid In tetrahydrofuran at 20℃; for 12h; | A 88% B 3% |
With Montmorillonite KSF; nitric acid; hafnium oxychloride In tetrahydrofuran at 20℃; for 16h; | A 81% B 6% |
With 3-(ethoxycarbonyl)-1-(5-methyl-5-(nitrosooxy)hexyl)pyridin-1-ium bis(trifluoromethanesulfonyl)imide at 20℃; for 6h; Ionic liquid; | A 78% B 16% |
4-methyl-2-nitrophenol
Conditions | Yield |
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With GLUTATHIONE In aq. phosphate buffer; acetonitrile at 37℃; for 4h; pH=7.4; Kinetics; | 88% |
(E)-methyl 3-(4-fluorophenyl)-2-((4-methyl-2-nitrophenoxy)methyl)acrylate
4-methyl-2-nitrophenol
Conditions | Yield |
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With GLUTATHIONE In aq. phosphate buffer; acetonitrile at 37℃; for 4h; pH=7.4; Kinetics; | 84% |
Conditions | Yield |
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With water In tetrahydrofuran at 25℃; for 2.5h; Schlenk technique; | 82% |
(E)-methyl 3-(4-methoxyphenyl)-2-((4-methyl-2-nitrophenoxy)methyl)acrylate
4-methyl-2-nitrophenol
Conditions | Yield |
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With GLUTATHIONE In aq. phosphate buffer; acetonitrile at 37℃; for 4h; pH=7.4; Kinetics; | 79% |
4-methyl-2-nitrophenol
Conditions | Yield |
---|---|
With GLUTATHIONE In aq. phosphate buffer; acetonitrile at 37℃; for 4h; pH=7.4; Kinetics; | 79% |
1. | orl-rat LD50:3360 mg/kg | HURC** Huntingdon Research Center Reports .(Brooklandville, MD.: )1972. |