Products Categories
| CAS No.: | 5715-02-6 |
|---|---|
| Name: | 2-ACETOXYBENZONITRILE |
| Article Data: | 9 |
| Molecular Structure: | |
|
|
|
| Formula: | C9H7NO2 |
| Molecular Weight: | 161.16 |
| Synonyms: | Salicylonitrile,acetate (6CI,7CI,8CI);2-Acetoxybenzonitrile;2-Cyanophenyl acetate;Acetylsalicylonitrile;o-Acetoxybenzonitrile; |
| EINECS: | 227-210-7 |
| Density: | 1.18g/cm3 |
| Melting Point: | 252-254 °C |
| Boiling Point: | 288.4 °C at 760 mmHg |
| Flash Point: | 132 °C |
| Appearance: | clear colourless to slightly yellow liquid |
| Hazard Symbols: |
 Xi
|
| PSA: | 50.09000 |
| LogP: | 1.48358 |
- 81281-59-67-Benzylideneaminotheophylline
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 717878-06-31-(4-fluorophenyl)-4-nitro-1H-imidazole
- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 894852-01-87-BROMO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
- Total:15 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The Benzonitrile,2-(acetyloxy)-, with CAS registry number 5715-02-6, belongs to the following product category: Aromatic Nitriles. It has the systematic name of 2-cyanophenyl acetate. This chemical is a kind of clear colourless to slightly yellow liquid. And the chemical formula of this chemical is C9H7NO2. What's more, its EINECS is 227-210-7.
Physical properties of Benzonitrile,2-(acetyloxy)-: (1)ACD/LogP: 1.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.33; (4)ACD/LogD (pH 7.4): 1.33; (5)ACD/BCF (pH 5.5): 6.04; (6)ACD/BCF (pH 7.4): 6.04; (7)ACD/KOC (pH 5.5): 126.04; (8)ACD/KOC (pH 7.4): 126.04; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 50.09 Å2; (13)Index of Refraction: 1.535; (14)Molar Refractivity: 42.43 cm3; (15)Molar Volume: 136.2 cm3; (16)Polarizability: 16.82×10-24cm3; (17)Surface Tension: 47 dyne/cm; (18)Density: 1.18 g/cm3; (19)Flash Point: 132 °C; (20)Enthalpy of Vaporization: 52.76 kJ/mol; (21)Boiling Point: 288.4 °C at 760 mmHg; (22)Vapour Pressure: 0.00234 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Oc1ccccc1C#N)C
(2)InChI: InChI=1/C9H7NO2/c1-7(11)12-9-5-3-2-4-8(9)6-10/h2-5H,1H3
(3)InChIKey: XXLKCUTUGWSJJO-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C9H7NO2/c1-7(11)12-9-5-3-2-4-8(9)6-10/h2-5H,1H3
(5)Std. InChIKey: XXLKCUTUGWSJJO-UHFFFAOYSA-N