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| Name |
Acetamide,2-chloro-N-(3-methoxyphenyl)- |
EINECS | N/A |
| CAS No. | 17641-08-6 | Density | 1.264 g/cm3 |
| PSA | 38.33000 | LogP | 1.94550 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C9H10ClNO2 | Boiling Point | 371.9 °C at 760 mmHg |
| Molecular Weight | 199.637 | Flash Point | 178.7 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
m-Acetanisidide,2-chloro- (8CI);2-Chloro-N-(3-methoxyphenyl)acetamide;N-(3-Anisyl)chloroacetamide;N-Chloroacetyl-3-methoxyaniline;acetamide, 2-chloro-N-(3-methoxyphenyl)-; |
Article Data | 67 |
Chloroiodomethane
3-methoxyphenyl isocyanate
2-chloro-N-(3-methoxyphenyl)acetamide
| Conditions | Yield |
|---|---|
| With methyllithium lithium bromide In diethyl ether at -78℃; | 94% |
| With methyllithium; lithium bromide In diethyl ether at -78℃; for 0.5h; chemoselective reaction; | 94% |
| Conditions | Yield |
|---|---|
| In tetrahydrofuran at 0 - 10℃; for 3h; | 92% |
| With N-ethyl-N,N-diisopropylamine In acetonitrile at 20℃; for 1h; Inert atmosphere; | 91.5% |
| With acetic acid at 20℃; for 1.5h; Cooling with ice; | 89% |
2-chloro-N-(3-methoxyphenyl)acetamide
2-hydroxybromobenzene
4-(3-methoxyphenyl)-2H-1,4-benzoxazin-3(4H)-one
| Conditions | Yield |
|---|---|
| With palladium diacetate; caesium carbonate; 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl In toluene at 110℃; for 24h; Inert atmosphere; | 91% |
| Conditions | Yield |
|---|---|
| Stage #1: ursonic acid With potassium carbonate In N,N-dimethyl-formamide at 20℃; for 0.5h; Stage #2: 2-chloro-N-(3-methoxyphenyl)acetamide With potassium iodide In N,N-dimethyl-formamide at 20℃; for 12h; | 88.6% |
2-chloro-N-(3-methoxyphenyl)acetamide
3-(3,4,5-trimethoxyphenyl)-4H-5-mercapto-1,2,4-triazole
| Conditions | Yield |
|---|---|
| With potassium carbonate In acetone at 20℃; Alkaline conditions; | 88% |
2-chloro-N-(3-methoxyphenyl)acetamide
| Conditions | Yield |
|---|---|
| Stage #1: 4-(4-hydroxybenzylidene)-1-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5(4H)-one With potassium carbonate In N,N-dimethyl-formamide at 20℃; for 0.5h; Stage #2: 2-chloro-N-(3-methoxyphenyl)acetamide In N,N-dimethyl-formamide at 100℃; for 8h; | 87% |
piperidine
2-chloro-N-(3-methoxyphenyl)acetamide
N-(3-methoxy-phenyl)-2-piperidin-1-yl-acetamide
| Conditions | Yield |
|---|---|
| In acetone for 2h; Heating; | 86% |
| With benzene |
2-chloro-N-(3-methoxyphenyl)acetamide
6-chloro-9-mercapto-2-methoxy-acridine
| Conditions | Yield |
|---|---|
| With potassium carbonate In acetone for 3h; Reflux; | 86% |
2-chloro-N-(3-methoxyphenyl)acetamide
| Conditions | Yield |
|---|---|
| In methanol Reflux; | 85% |
2-chloro-N-(3-methoxyphenyl)acetamide
4-tert-butyl-2-iodophenol
6-tert-butyl-4-(3-methoxyphenyl)-2H-1,4-benzoxazin-3(4H)-one
| Conditions | Yield |
|---|---|
| With copper(l) iodide; caesium carbonate; 1,8-diazabicyclo[5.4.0]undec-7-ene In dimethyl sulfoxide at 130℃; for 0.166667h; Microwave irradiation; | 84% |
The Acetamide,2-chloro-N-(3-methoxyphenyl)-, with the CAS registry number 17641-08-6, has the systematic name of 2-chloro-N-(3-methoxyphenyl)acetamide. It is also called m-Acetanisidide, 2-chloro-. And the molecular formula of this chemical is C9H10ClNO2.
The physical properties of Acetamide,2-chloro-N-(3-methoxyphenyl)- are as following: (1)ACD/LogP: 1.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.8; (4)ACD/LogD (pH 7.4): 1.8; (5)ACD/BCF (pH 5.5): 13.69; (6)ACD/BCF (pH 7.4): 13.68; (7)ACD/KOC (pH 5.5): 226.43; (8)ACD/KOC (pH 7.4): 226.43; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.573; (14)Molar Refractivity: 52.05 cm3; (15)Molar Volume: 157.9 cm3; (16)Polarizability: 20.63×10-24cm3; (17)Surface Tension: 43.7 dyne/cm; (18)Density: 1.264 g/cm3; (19)Flash Point: 178.7 °C; (20)Enthalpy of Vaporization: 61.9 kJ/mol; (21)Boiling Point: 371.9 °C at 760 mmHg; (22)Vapour Pressure: 9.98E-06 mmHg at 25°C.
Preparation of Acetamide,2-chloro-N-(3-methoxyphenyl)-: It can be prepared by 3-methoxy-aniline and chloroacetyl chloride. The reaction will need solvent acetic aci. The reaction time is 2 hours with temperature of 15-50°C.
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Uses of Acetamide,2-chloro-N-(3-methoxyphenyl)-: It can react with piperidine to produce N-(3-methoxy-phenyl)-2-piperidin-1-yl-acetamide. This reaction will need reagent benzene.
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You can still convert the following datas into molecular structure:
(1)SMILES: ClCC(=O)Nc1cccc(OC)c1
(2)InChI: InChI=1/C9H10ClNO2/c1-13-8-4-2-3-7(5-8)11-9(12)6-10/h2-5H,6H2,1H3,(H,11,12)
(3)InChIKey: JJNAIBJFYFWTIA-UHFFFAOYAT
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 180mg/kg (180mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02936, |
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