Products Categories
| CAS No.: | 123843-66-3 |
|---|---|
| Name: | 2,6-Difluoro-4-methoxybenzonitrile |
| Article Data: | 4 |
| Molecular Structure: | |
|
|
|
| Formula: | C8H5F2NO |
| Molecular Weight: | 169.131 |
| Synonyms: | 2,6-Difluoro-4-methoxybenzonitrile;2,6-difluoro-4-methoxybenzonitrile;Benzonitrile, 2,6-difluoro-4-methoxy-;NCR BF FF DO1; |
| Density: | 1.279 g/cm3 |
| Melting Point: | 53-57℃ |
| Boiling Point: | 211.683 °C at 760 mmHg |
| Flash Point: | 81.823 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-37/39 |
| Transport Information: | UN 3439 |
| PSA: | 33.02000 |
| LogP: | 1.84508 |
- 144851-82-1METHYL2-AMINO-3-FLUOROBENZOATE
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 173606-50-3BOC-10-AMINODECANOIC ACID
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- Total:38 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The 2,6-Difluoro-4-methoxybenzonitrile, with the CAS registry number 123843-66-3, has the systematic name and IUPAC name of 2,6-difluoro-4-methoxybenzonitrile. It belongs to the product category of Aromatic Nitriles. And the molecular formula of the chemical is C8H5F2NO.
The characteristics of 2,6-Difluoro-4-methoxybenzonitrile are as followings: (1)ACD/LogP: 1.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.71; (4)ACD/LogD (pH 7.4): 1.71; (5)ACD/BCF (pH 5.5): 11.77; (6)ACD/BCF (pH 7.4): 11.77; (7)ACD/KOC (pH 5.5): 203.22; (8)ACD/KOC (pH 7.4): 203.22; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 33.02 Å2; (13)Index of Refraction: 1.485; (14)Molar Refractivity: 37.91 cm3; (15)Molar Volume: 132.1 cm3; (16)Polarizability: 15.02×10-24cm3; (17)Surface Tension: 37.1 dyne/cm; (18)Density: 1.27 g/cm3; (19)Flash Point: 81.8 °C; (20)Enthalpy of Vaporization: 44.8 kJ/mol; (21)Boiling Point: 211.7 °C at 760 mmHg; (22)Vapour Pressure: 0.18 mmHg at 25°C.
You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Fc1c(C#N)c(F)cc(OC)c1
(2)InChI: InChI=1/C8H5F2NO/c1-12-5-2-7(9)6(4-11)8(10)3-5/h2-3H,1H3
(3)InChIKey: CMGFDVIQHBAJHT-UHFFFAOYAP