Acetamide, N-(5-chloro-2-nitrophenyl)- supplier

Name
5-CHLORO-2-NITROACETYLANILINE
EINECS 216-661-5
CAS No. 5443-33-4
Article Data20
CAS DataBase
Density 1.466 g/cm³
Solubility
Melting Point 126-129℃
Formula C₈H₇ClN₂O₃
Boiling Point 405.5 °C at 760 mmHg
Molecular Weight 214.608
Flash Point 199.1 °C
Transport Information
Appearance
Safety
Risk Codes T+:Very toxic;
Molecular Structure
Hazard Symbols R26/27/28:; R33:; R51/53:;
Synonyms Acetanilide,5'-chloro-2'-nitro- (6CI);3'-Chloro-6'-nitroacetanilide;5'-Chloro-2'-nitroacetanilide;N-Acetyl-5-chloro-2-nitroaniline;NSC 12464;N-(5-Chloro-2-nitrophenyl)acetamide;
PSA 74.92000
LogP 2.80280

Acetamide, N-(5-chloro-2-nitrophenyl)- Specification

The Acetamide, N-(5-chloro-2-nitrophenyl)-, with the CAS registry number 5443-33-4, is also known as 5'-Chloro-2'-nitroacetanilide. This chemical's molecular formula is C₈H₇ClN₂O₃ and molecular weight is 214.61. What's more, its systematic name is N-(5-Chloro-2-nitrophenyl)acetamide.

Physical properties of Acetamide, N-(5-chloro-2-nitrophenyl)- are: (1)ACD/LogP: 1.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.78; (4)ACD/LogD (pH 7.4): 1.78; (5)ACD/BCF (pH 5.5): 13.25; (6)ACD/BCF (pH 7.4): 13.25; (7)ACD/KOC (pH 5.5): 221.26; (8)ACD/KOC (pH 7.4): 221.26; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 66.13 Å²; (13)Index of Refraction: 1.628; (14)Molar Refractivity: 51.96 cm³; (15)Molar Volume: 146.3 cm³; (16)Polarizability: 20.6×10^-24cm³; (17)Surface Tension: 57.2 dyne/cm; (18)Density: 1.466 g/cm³; (19)Flash Point: 199.1 °C; (20)Enthalpy of Vaporization: 65.71 kJ/mol; (21)Boiling Point: 405.5 °C at 760 mmHg; (22)Vapour Pressure: 8.7E-07 mmHg at 25°C.

Uses of Acetamide, N-(5-chloro-2-nitrophenyl)-: it can be used to produce 3,3'-diamino-4,4'-dinitrodiphenyl sulfide by heating. It will need reagent Na₂S and solvents ethanol, H₂O with the reaction time of 12 hours. The yield is about 38.5%.

Acetamide, N-(5-chloro-2-nitrophenyl)- can be used to produce 3,3'-diamino-4,4'-dinitrodiphenyl sulfide by heating

You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1c(cc(Cl)cc1)NC(=O)C
(2)InChI: InChI=1S/C8H7ClN2O3/c1-5(12)10-7-4-6(9)2-3-8(7)11(13)14/h2-4H,1H3,(H,10,12)
(3)InChIKey: YWANGSCDWBUSBK-UHFFFAOYSA-N

Product Name

5-CHLORO-2-NITROACETYLANILINE

Acetamide, N-(5-chloro-2-nitrophenyl)- Specification

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