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| CAS No.: | 10128-55-9 |
|---|---|
| Name: | N-[2-(4-Oxo-4H-3,1-benzoxazin-2-yl)phenyl]-2-naphthalenesulfonamide |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C24H16N2O4S |
| Molecular Weight: | 428.468 |
| Synonyms: | 2-Naphthalenesulfonanilide,2'-(4-oxo-4H-3,1-benzoxazin-2-yl)- (7CI,8CI);4H-3,1-Benzoxazine,2-naphthalenesulfonamide deriv.;N-[2-(4-Oxo-4H-3,1-benzoxazin-2-yl)phenyl]-2-naphthalenesulfonamide; |
| EINECS: | 233-360-4 |
| Density: | 1.38 g/cm3 |
| Melting Point: | 184.8-185.5 °C |
| Boiling Point: | 629.7 °C at 760 mmHg |
| Flash Point: | 334.6 °C |
| Solubility: | 46.11μg/L at 18.8℃ |
| PSA: | 97.65000 |
| LogP: | 5.96280 |
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2-(2'-amino-phenyl)-benzo[d][1,3]oxazin-4-one
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pyrographite
- 93-11-8
2-Naphthalenesulfonyl chloride
- 10128-55-9
N-[2-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]naphthalene-2-sulfonamide
| Conditions | Yield |
|---|---|
| In pyridine; dichloromethane; ethyl acetate |
- 64-17-5
ethanol
- 10128-55-9
N-[2-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]naphthalene-2-sulfonamide
- 1318027-89-2
2-[2-(naphthalene-2-sulfonylamino)-benzoylamino]-benzoic acid ethyl ester
| Conditions | Yield |
|---|---|
| With sodium hydroxide | 97% |
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Specification
The cas register number of N-[2-(4-Oxo-4H-3,1-benzoxazin-2-yl)phenyl]-2-naphthalenesulfonamide is 10128-55-9. It also can be called as 2-Naphthalenesulfonamide, N-(2-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl)- and the Systematic name about this chemical is N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]naphthalene-2-sulfonamide. It belongs to the Piperazine derivates.
Physical properties about N-[2-(4-Oxo-4H-3,1-benzoxazin-2-yl)phenyl]-2-naphthalenesulfonamide are: (1)ACD/LogP: 4.39; (2)ACD/LogD (pH 5.5): 4.39; (3)ACD/LogD (pH 7.4): 4.24; (4)ACD/BCF (pH 5.5): 1268.81; (5)ACD/BCF (pH 7.4): 899.45; (6)ACD/KOC (pH 5.5): 5785.63; (7)ACD/KOC (pH 7.4): 4101.41; (8)#H bond acceptors: 6; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 84.42Å2; (12)Index of Refraction: 1.691; (13)Molar Refractivity: 118.51 cm3; (14)Molar Volume: 309.5 cm3; (15)Polarizability: 46.98x10-24cm3; (16)Surface Tension: 57.5 dyne/cm; (17)Enthalpy of Vaporization: 93.15 kJ/mol; (18)Vapour Pressure: 9.09E-16 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c2cc1ccccc1cc2)Nc5ccccc5C/4=N/c3c(cccc3)C(=O)O\4
(2)InChI: InChI=1/C24H16N2O4S/c27-24-20-10-4-5-11-21(20)25-23(30-24)19-9-3-6-12-22(19)26-31(28,29)18-14-13-16-7-1-2-8-17(16)15-18/h1-15,26H
(3)InChIKey: SYRKOPHMPLPLPQ-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C24H16N2O4S/c27-24-20-10-4-5-11-21(20)25-23(30-24)19-9-3-6-12-22(19)26-31(28,29)18-14-13-16-7-1-2-8-17(16)15-18/h1-15,26H(5)Std. InChIKey: SYRKOPHMPLPLPQ-UHFFFAOYSA-N