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Cas Database |
| Name |
3-Amino-4-nitrophenol |
EINECS | N/A |
| CAS No. | 16292-90-3 | Density | 1.511 g/cm3 |
| PSA | 92.07000 | LogP | 1.98700 |
| Solubility | N/A | Melting Point |
183-184 °C |
| Formula | C6H6N2O3 | Boiling Point | 396.1 °C at 760 mmHg |
| Molecular Weight | 154.125 | Flash Point | 193.4 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1-Nitro-2-amino-4-hydroxybenzene;2-Amino-4-hydroxynitrobenzene;3-Amino-4-nitrophenol;4-Nitro-3-aminophenol;5-Hydroxy-2-nitroaniline; |
Article Data | 3 |
3-Amino-4-nitrophenol Synthetic route
- 67915-26-8
N-(5-hydroxy-2-nitrophenyl)acetamide
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
| Conditions | Yield |
|---|---|
| With hydrogenchloride; water at 110℃; for 0.0833333h; Heating; | 95% |
| With sulfuric acid |
- 1635-61-6
5-chloro-2-nitroaniline
A
- 611-07-4
5-chloro-2-nitrophenol
B
- 3163-07-3
4-nitroresorcinol
C
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
| Conditions | Yield |
|---|---|
| With water; sodium hydroxide at 100℃; for 50h; | A 68% B 7% C 25% |
| With tetra(n-butyl)ammonium hydroxide; water at 100℃; for 16h; | A 32% B 1% C 57% |
- 6317-89-1
3-acetamidophenyl acetate
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: nitric acid 2: sulfuric acid View Scheme |
- 621-42-1
meta-hydroxyacetanilide
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: nitric acid; acetic anhydride / acetic acid / 8 h / 25 °C 2: hydrogenchloride; water / 0.08 h / 110 °C / Heating View Scheme |
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
- 115314-14-2
(2s)-(+)-glycidyl 3-nitrobenzenesulfonate
- 179929-91-0
(S)-2-nitro-4-(oxiran-2-ylmethoxy)aniline
| Conditions | Yield |
|---|---|
| With potassium carbonate In acetone for 18h; Reflux; | 86.7% |
- 696-59-3
cis,trans-2,5-dimethoxytetrahydrofuran
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
| Conditions | Yield |
|---|---|
| Stage #1: cis,trans-2,5-dimethoxytetrahydrofuran; 2-amino-4-hydroxy-1-nitrobenzene In 1,4-dioxane for 0.25h; Clauson-Kaas Synthesis; Heating; Stage #2: With hydrogenchloride In 1,4-dioxane; water at 110℃; | 70% |
- 110-91-8
morpholine
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
- 109-64-8
1,3-dibromo-propane
- 694533-05-6
5-[3-(4-morpholinyl)propoxy]-2-nitroaniline
| Conditions | Yield |
|---|---|
| Stage #1: morpholine; 1,3-dibromo-propane With pyridine Stage #2: 2-amino-4-hydroxy-1-nitrobenzene With caesium carbonate | 69% |
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
| Conditions | Yield |
|---|---|
| Stage #1: 2-amino-4-hydroxy-1-nitrobenzene With potassium tert-butylate In N,N-dimethyl-formamide at 20℃; for 0.0833333h; Inert atmosphere; Stage #2: (5-methoxypyrazin-2-yl)methyl methanesulfonate In N,N-dimethyl-formamide at 20℃; for 16h; | 54% |
- 622-40-2
2-(morpholin-4-yl)ethanol
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
- 1104467-53-9
5-(2-morpholin-4-ylethoxy)-2-nitrophenylamine
| Conditions | Yield |
|---|---|
| With di-isopropyl azodicarboxylate; triphenylphosphine In tetrahydrofuran at 0 - 20℃; Mitsunobu reaction; | 32% |
| With di-isopropyl azodicarboxylate; triphenylphosphine In tetrahydrofuran at 0 - 20℃; for 18h; |
- 16292-90-3
2-amino-4-hydroxy-1-nitrobenzene
- 100-02-7
4-nitro-phenol
| Conditions | Yield |
|---|---|
| Diazotization.Verkochen des Produktes mit absol. Alkohol; | |
| und Verkochen mit absol.Alkohol.Diazotization; |
3-Amino-4-nitrophenol Specification
The 3-Amino-4-nitrophenol, with the CAS registry number 16292-90-3, is also known as Phenol, 3-amino-4-nitro-. This chemical's molecular formula is C6H6N2O3 and molecular weight is 154.12. Its IUPAC name is called 3-amino-4-nitrophenol.
Physical properties of 3-Amino-4-nitrophenol: (1)ACD/LogP: 1.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.59; (4)ACD/LogD (pH 7.4): 1.42; (5)ACD/BCF (pH 5.5): 9.49; (6)ACD/BCF (pH 7.4): 6.45; (7)ACD/KOC (pH 5.5): 173.96; (8)ACD/KOC (pH 7.4): 118.27; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.688; (13)Molar Refractivity: 38.91 cm3; (14)Molar Volume: 101.9 cm3; (15)Surface Tension: 78.5 dyne/cm; (16)Density: 1.511 g/cm3; (17)Flash Point: 193.4 °C; (18)Enthalpy of Vaporization: 67.16 kJ/mol; (19)Boiling Point: 396.1 °C at 760 mmHg; (20)Vapour Pressure: 7.67E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1O)N)[N+](=O)[O-]
(2)InChI: InChI=1S/C6H6N2O3/c7-5-3-4(9)1-2-6(5)8(10)11/h1-3,9H,7H2
(3)InChIKey: WGEZJWMZNGUEHR-UHFFFAOYSA-N
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