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Name |
Acetamide,2-chloro-N-(2,4-dinitrophenyl)- |
EINECS | N/A |
CAS No. | 6271-08-5 | Density | 1.647 g/cm3 |
PSA | 120.74000 | LogP | 2.79970 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H6ClN3O5 | Boiling Point | 486.7 °C at 760 mmHg |
Molecular Weight | 259.606 | Flash Point | 248.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Acetanilide,2-chloro-2',4'-dinitro- (7CI);2-Chloro-N-(2,4-dinitrophenyl)acetamide;NSC37405;acetamide, 2-chloro-N-(2,4-dinitrophenyl)-; |
Article Data | 8 |
The Acetamide,2-chloro-N-(2,4-dinitrophenyl)-, with the CAS registry number 6271-08-5, has the systematic name of 2-chloro-N-(2,4-dinitrophenyl)acetamide. It should be stored in the dry and cool environment. And the molecular formula of this chemical is C8H6ClN3O5.
The physical properties of Acetamide,2-chloro-N-(2,4-dinitrophenyl)- are as following: (1)ACD/LogP: 2.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.06; (4)ACD/LogD (pH 7.4): 2.06; (5)ACD/BCF (pH 5.5): 21.73; (6)ACD/BCF (pH 7.4): 21.71; (7)ACD/KOC (pH 5.5): 315.31; (8)ACD/KOC (pH 7.4): 315; (9)#H bond acceptors: 8; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 111.95 Å2; (13)Index of Refraction: 1.664; (14)Molar Refractivity: 58.46 cm3; (15)Molar Volume: 157.5 cm3; (16)Polarizability: 23.17×10-24cm3; (17)Surface Tension: 72.8 dyne/cm; (18)Density: 1.647 g/cm3; (19)Flash Point: 248.1 °C; (20)Enthalpy of Vaporization: 75.24 kJ/mol; (21)Boiling Point: 486.7 °C at 760 mmHg; (22)Vapour Pressure: 1.27E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)CCl
(2)InChI: InChI=1/C8H6ClN3O5/c9-4-8(13)10-6-2-1-5(11(14)15)3-7(6)12(16)17/h1-3H,4H2,(H,10,13)
(3)InChIKey: BJYSEWOCLXWPLH-UHFFFAOYAY
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