|
Basic Information |
|
Post buying leads |
|
Suppliers |
| Name |
Acetamide,N-(1,3-dihydro-1,3-dioxo-4-isobenzofuranyl)- |
EINECS | 808-040-8 |
| CAS No. | 6296-53-3 | Density | 1.512 g/cm3 |
| PSA | 72.47000 | LogP | 1.02860 |
| Solubility | N/A | Melting Point |
185-186℃ |
| Formula | C10H7NO4 | Boiling Point | 489.1 °C at 760 mmHg |
| Molecular Weight | 205.17 | Flash Point | 249.6 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Phthalicanhydride, 3-acetamido- (6CI,8CI);3-Acetamidophthalic anhydride;3-Acetylaminophthalic anhydride;NSC 16261;NSC 17048;AC1L5EJ7;AC1Q6H8C;n-(1,3-Dioxo-1,3-dihydro-2-benzofuran-4-yl)acetamide;AKOS002687661;N-(1,3-dioxo-2-benzofuran-4-yl)acetamide; |
| Conditions | Yield |
|---|---|
| In Isopropyl acetate at 75 - 95℃; Temperature; Large scale; | 88.6% |
| Conditions | Yield |
|---|---|
| With palladium 10% on activated carbon; hydrogen at 80 - 115℃; under 7500.75 Torr; Temperature; Autoclave; | 83% |
| Conditions | Yield |
|---|---|
| for 4h; Concentration; Temperature; Reflux; | 78.5% |
| at 0 - 5℃; for 4h; Heating / reflux; | 61% |
| for 3h; Reflux; | 61% |
| Conditions | Yield |
|---|---|
| With acetic anhydride; palladium Hydrogenation; |
3-acetylaminophthalic anhydride
| Conditions | Yield |
|---|---|
| With acetic anhydride |
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: tin dichloride; hydrochloric acid View Scheme | |
| Multi-step reaction with 2 steps 1: hydrogen / palladium-carbon / ethanol 2: acetic anhydride View Scheme | |
| Multi-step reaction with 2 steps 1: palladium 10% on activated carbon; hydrogen / ethanol / 13 h / 2585.81 - 2844.39 Torr / Inert atmosphere 2: 3 h / Reflux View Scheme |
| Conditions | Yield |
|---|---|
| With acetic anhydride | |
| With acetic anhydride | |
| With acetic anhydride | |
| With acetic anhydride | |
| Multi-step reaction with 2 steps 1: hydrogenchloride / water / 15 h / 25 °C 2: water / 15 h / 100 °C View Scheme |
acetic anhydride
3-aminophthalic acid hydrochloride
3-acetylaminophthalic anhydride
| Conditions | Yield |
|---|---|
| In water at 100℃; for 15h; | 94 g |
| at 110℃; for 2h; | 45 g |
| at 80 - 140℃; for 3h; |
The Acetamide,N-(1,3-dihydro-1,3-dioxo-4-isobenzofuranyl)- with CAS registry number of 6296-53-3 is also known as 3-Acetylaminophthalic anhydride. The IUPAC name is N-(1,3-Dioxo-2-benzofuran-4-yl)acetamide. In addition, the formula is C10H7NO4 and the molecular weight is 205.17.
Physical properties about Acetamide,N-(1,3-dihydro-1,3-dioxo-4-isobenzofuranyl)- are: (1)ACD/LogP: 0.46; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.46; (4)ACD/LogD (pH 7.4): 0.46; (5)ACD/BCF (pH 5.5): 1.33; (6)ACD/BCF (pH 7.4): 1.33; (7)ACD/KOC (pH 5.5): 42.61; (8)ACD/KOC (pH 7.4): 42.61; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 63.68Å2; (13)Index of Refraction: 1.657; (14)Molar Refractivity: 49.95 cm3; (15)Molar Volume: 135.6 cm3; (16)Polarizability: 19.8×10-24cm3; (17)Surface Tension: 71.8 dyne/cm; (18)Density: 1.512 g/cm3; (19)Flash Point: 249.6 °C; (20)Enthalpy of Vaporization: 75.53 kJ/mol; (21)Boiling Point: 489.1 °C at 760 mmHg; (22)Vapour Pressure: 1.03E-09 mmHg at 25 °C
You can still convert the following datas into molecular structure:
1. SMILES: O=C1OC(=O)c2c1cccc2NC(=O)C
2. InChI: InChI=1/C10H7NO4/c1-5(12)11-7-4-2-3-6-8(7)10(14)15-9(6)13/h2-4H,1H3,(H,11,12)
3. InChIKey: PAUAJOABXCGLCN-UHFFFAOYAP
4. Std. InChI: InChI=1S/C10H7NO4/c1-5(12)11-7-4-2-3-6-8(7)10(14)15-9(6)13/h2-4H,1H3,(H,11,12)
5. Std. InChIKey: PAUAJOABXCGLCN-UHFFFAOYSA-N
Please post your buying leads,so that our qualified suppliers will soon
contact you!
*Required Fields
