Acetamide,N-[4-[[2-(aminosulfonyl)-4-nitrophenyl]sulfonyl]phenyl]- supplier

Name
N-[4-(4-NITRO-2-SULFAMOYL-BENZENESULFONYL)-PHENYL]-ACETAMIDE
EINECS
CAS No. 25006-65-9
Density 1.587 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₃N₃O₇S₂
Boiling Point
Molecular Weight 399.405
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Acetanilide,4'-[(4-nitro-2-sulfamoylphenyl)sulfonyl]- (8CI);N-[4-(4-Nitro-2-sulfamoylphenyl)sulfonylphenyl]acetamide;
PSA 185.98000
LogP 4.49150

Acetamide,N-[4-[[2-(aminosulfonyl)-4-nitrophenyl]sulfonyl]phenyl]- Specification

The Acetamide,N-[4-[[2-(aminosulfonyl)-4-nitrophenyl]sulfonyl]phenyl]- is an organic compound with the formula C₁₄H₁₃N₃O₇S₂. The IUPAC name of this chemical is N-[4-(4-Nitro-2-sulfamoylphenyl)sulfonylphenyl]acetamide. The CAS registry number of this chemical is 25006-65-9. Besides, its molecular weight is 399.40.

The physical properties of Acetamide,N-[4-[[2-(aminosulfonyl)-4-nitrophenyl]sulfonyl]phenyl]- are: (1)ACD/LogP: 0.59; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0.593; (4)ACD/LogD (pH 7.4): 0.573; (5)ACD/BCF (pH 5.5): 1.662; (6)ACD/BCF (pH 7.4): 1.588; (7)ACD/KOC (pH 5.5): 50.062; (8)ACD/KOC (pH 7.4): 47.833; (9)#H bond acceptors: 10; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 185.98 Å²; (13)Index of Refraction: 1.65; (14)Molar Refractivity: 91.774 cm³; (15)Molar Volume: 251.668 cm³; (16)Polarizability: 36.382×10^-24 cm³; (17)Surface Tension: 72.19 dyne/cm; (18)Density: 1.587 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)Nc1ccc(cc1)S(=O)(=O)c2ccc(cc2S(=O)(=O)N)[N+](=O)[O-]
(2)InChI: InChI=1/C14H13N3O7S2/c1-9(18)16-10-2-5-12(6-3-10)25(21,22)13-7-4-11(17(19)20)8-14(13)26(15,23)24/h2-8H,1H3,(H,16,18)(H2,15,23,24)
(3)InChIKey: RRYXROFGJIJXCP-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C14H13N3O7S2/c1-9(18)16-10-2-5-12(6-3-10)25(21,22)13-7-4-11(17(19)20)8-14(13)26(15,23)24/h2-8H,1H3,(H,16,18)(H2,15,23,24)
(5)Std. InChIKey: RRYXROFGJIJXCP-UHFFFAOYSA-N

Product Name

N-[4-(4-NITRO-2-SULFAMOYL-BENZENESULFONYL)-PHENYL]-ACETAMIDE

Acetamide,N-[4-[[2-(aminosulfonyl)-4-nitrophenyl]sulfonyl]phenyl]- Specification

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