Basic Information | Post buying leads | Suppliers |
Name |
N-(1-Nitro-2-naphthalenyl)acetamide |
EINECS | N/A |
CAS No. | 5419-82-9 | Density | 1.366 g/cm3 |
PSA | 74.92000 | LogP | 3.30260 |
Solubility | N/A | Melting Point |
N/A |
Formula | C12H10N2O3 | Boiling Point | 474.1 °C at 760 mmHg |
Molecular Weight | 230.223 | Flash Point | 240.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Acetamido-1-nitronaphthalene; |
The N-(1-Nitro-2-naphthalenyl)acetamide with the cas number 5419-82-9 is also called 2-Acetamido-1-nitronaphthalene. Both the systematic name and IUPAC name are N-(1-nitronaphthalen-2-yl)acetamide. Its molecular formula is C12H10N2O3.
The properties of the chemical are: (1)ACD/LogP: 2.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.23; (4)ACD/LogD (pH 7.4): 2.23; (5)ACD/BCF (pH 5.5): 29.2; (6)ACD/BCF (pH 7.4): 29.2; (7)ACD/KOC (pH 5.5): 389.49; (8)ACD/KOC (pH 7.4): 389.49; (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: 1.697; (14)Molar Refractivity: 64.91 cm3; (15)Molar Volume: 168.4 cm3; (16)Polarizability: 25.73×10-24cm3; (17)Surface Tension: 60.7 dyne/cm; (18)Enthalpy of Vaporization: 73.73 kJ/mol; (19)Vapour Pressure: 3.73×10-9 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1c2c(ccc1NC(=O)C)cccc2
(2)InChI: InChI=1/C12H10N2O3/c1-8(15)13-11-7-6-9-4-2-3-5-10(9)12(11)14(16)17/h2-7H,1H3,(H,13,15)
(3)InChIKey: ZDOWETIOQWADNW-UHFFFAOYAC