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Name |
N-(1-Cyanonaphthalen-2-yl)acetamide |
EINECS | N/A |
CAS No. | 6329-24-4 | Density | 1.22 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C13H10N2O | Boiling Point | 486.7 °C at 760 mmHg |
Molecular Weight | 210.2313 | Flash Point | 248.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Acetamide, N-(1-cyano-2-naphthalenyl)-;N-(1-cyano-2-naphthyl)acetamide; |
Article Data | 3 |
This chemical is called N-(1-Cyanonaphthalen-2-yl)acetamide, and it can also be named as Acetamide, N-(1-cyano-2-naphthalenyl)-. With the molecular formula of C13H10N2O, its molecular weight is 210.2313. The CAS registry number of this chemical is 6329-24-4, and its systematic name is N-(1-cyanonaphthalen-2-yl)acetamide.
Other characteristics of the N-(1-Cyanonaphthalen-2-yl)acetamide can be summarised as followings: (1)(1)ACD/LogP: 1.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.8; (4)ACD/LogD (pH 7.4): 1.8; (5)ACD/BCF (pH 5.5): 13.74; (6)ACD/BCF (pH 7.4): 13.74; (7)ACD/KOC (pH 5.5): 227.05; (8)ACD/KOC (pH 7.4): 227.05; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 44.1 Å2; (13)Index of Refraction: 1.641; (14)Molar Refractivity: 61.89 cm3; (15)Molar Volume: 171.5 cm3; (16)Polarizability: 24.53×10-24 cm3; (17)Surface Tension: 56.1 dyne/cm; (18)Density: 1.22 g/cm3; (19)Flash Point: 248.1 °C; (20)Enthalpy of Vaporization: 75.25 kJ/mol; (21)Boiling Point: 486.7 °C at 760 mmHg; (22)Vapour Pressure: 1.27E-09 mmHg at 25°C.
Production method of this chemical: The N-(1-Cyanonaphthalen-2-yl)acetamide could be obtained by the reactants of acetic acid anhydride and potassium salt of 1,1-Dicyano-2-hydroxy-2-(1-cyano-2-naphthylamino)ethylene. This reaction needs the solvent of acetic acid. The yield is 36 %. In addition, this reaction should be taken for 3 hours. The other condition is heating.
You can still convert the following datas into molecular structure:
1.SMILES: N#Cc1c2c(ccc1NC(=O)C)cccc2
2.InChI: InChI=1/C13H10N2O/c1-9(16)15-13-7-6-10-4-2-3-5-11(10)12(13)8-14/h2-7H,1H3,(H,15,16)
3.InChIKey: FDTWGIMHPCGOJX-UHFFFAOYAA