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CAS No.: | 2243-69-8 |
---|---|
Name: | 4-Acetoxy-1-acetylamino-2-nitro-benzene |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C10H10N2O5 |
Molecular Weight: | 238.2 |
Synonyms: | Acetanilide,4'-hydroxy-2'-nitro-, acetate (6CI,7CI,8CI);4-(Acetylamino)-3-nitrophenylacetate;4-Acetoxy-2-nitroacetanilide;N,O-Diacetyl-4-amino-3-nitrophenol;NSC1325;1-Acetamido-4-acetoxy-2-nitro-benzene; |
Density: | 1.384 g/cm3 |
Melting Point: | 144-146°C |
Boiling Point: | 439.6 °C at 760 mmHg |
Flash Point: | 219.6 °C |
PSA: | 101.22000 |
LogP: | 2.07470 |
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The CAS register number of Acetamide,N-[4-(acetyloxy)-2-nitrophenyl]- is 2243-69-8. It also can be called as 1-Acetamido-4-acetoxy-2-nitro-benzene and the systematic name about this chemical is 4-(acetylamino)-3-nitrophenyl acetate. The molecular formula about this chemical is C10H10N2O5 and the molecular weight is 238.20. It belongs to the following product categories which include Chemical Amines; Amines; Aromatics and so on.
Physical properties about Acetamide,N-[4-(acetyloxy)-2-nitrophenyl]- are: (1)ACD/LogP: 1.05; (2)ACD/LogD (pH 5.5): 1.05; (3)ACD/LogD (pH 7.4): 1.05; (4)ACD/BCF (pH 5.5): 3.71; (5)ACD/BCF (pH 7.4): 3.71; (6)ACD/KOC (pH 5.5): 88.94; (7)ACD/KOC (pH 7.4): 88.94; (8)#H bond acceptors: 7; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 92.43 Å2; (12)Index of Refraction: 1.594; (13)Molar Refractivity: 58.41 cm3; (14)Molar Volume: 171.9 cm3; (15)Polarizability: 23.15x10-24cm3; (16)Surface Tension: 54.8 dyne/cm; (17)Density: 1.384 g/cm3; (18)Flash Point: 219.6 °C; (19)Enthalpy of Vaporization: 69.65 kJ/mol; (20)Boiling Point: 439.6 °C at 760 mmHg; (21)Vapour Pressure: 6.32E-08 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Oc1ccc(c(c1)[N+]([O-])=O)NC(=O)C)C
(2)InChI: InChI=1/C10H10N2O5/c1-6(13)11-9-4-3-8(17-7(2)14)5-10(9)12(15)16/h3-5H,1-2H3,(H,11,13)
(3)InChIKey: HSCNPJOXRGUVFK-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C10H10N2O5/c1-6(13)11-9-4-3-8(17-7(2)14)5-10(9)12(15)16/h3-5H,1-2H3,(H,11,13)
(5)Std. InChIKey: HSCNPJOXRGUVFK-UHFFFAOYSA-N