4,4′-DIAMINOOCTAFLUOROBIPHENYL CAS#: 1038-66-0; ChemWhat Code: 105696
Identification
| Product Name | 4,4′-DIAMINOOCTAFLUOROBIPHENYL CAS#: 1038-66-0 |
| IUPAC Name | 4-(4-amino-2,3,5,6-tetrafluorophenyl)-2,3,5,6-tetrafluoroaniline |
| Molecular Structure |  |
| CAS Registry Number | 1038-66-0 |
| Synonyms | 4,4′-Diaminooctafluorobiphenyl 1038-66-0 Octafluorobenzidine 2,2′,3,3′,5,5′,6,6′-Octafluoro-[1,1′-biphenyl]-4,4′-diamine 4,4′-Diaminooctafluorodiphenyl [1,1′-Biphenyl]-4,4′-diamine, 2,2′,3,3′,5,5′,6,6′-octafluoro- 4-(4-amino-2,3,5,6-tetrafluorophenyl)-2,3,5,6-tetrafluoroaniline 2,2′,3,3′,5,5′,6,6′-Octafluorobenzidine 4,4′-Diaminoctafluorobiphenyl MFCD00007646 Benzidine, 2,2′,3,3′,5,5′,6,6′-octafluoro- 4,4′-Biphenyldiamine, 2,2′,3,3′,5,5′,6,6′-octafluoro- 4,4/’-DIAMINOOCTAFLUOROBIPHENYL (1,1′-Biphenyl)-4,4′-diamine, 2,2′,3,3′,5,5′,6,6′-octafluoro- Benzidine, octafluoro- C12H4F8N2 Octafluoro-4,4′-biphenylenediamine EINECS 213-861-4 NSC 88339 2,2′,3,3′,5,5′,6,6′-octafluoro-4,4′-bibenzenamine AI3-52506 NCIOpen2_009601 YSWG727 4,4-Diaminooctafluorobiphenyl SCHEMBL600277 DTXSID8061424 4,4”-Diaminooctafluorobiphenyl NSC88339 2,2′,3,3′,5,5′,6,6′-Octafluoro[1,1′-biphenyl]-4,4′-diamine NSC-88339 AKOS007930313 FS-4814 SY050353 4,4′-Diaminooctafluorobiphenyl, >/=97% 2,3,3′,5,5′,6,6′-Octafluorobenzidine DB-040489 CS-0121222 D1632 NS00015799 A11847 Benzidine,2′,3,3′,5,5′,6,6′-octafluoro- 4, 2,2′,3,3′,5,5′,6,6′-octafluoro- OCTAFLUORO-[1,1′-BIPHENYL]-4,4′-DIAMINE 4,4′-Diaminooctafluorobiphenyl, 90%, technical grade [1,4′-diamine, 2,2′,3,3′,5,5′,6,6′-octafluoro- 2,2′,3,3′,5,5′,6,6′-octafluorobiphenyl-4,4′-diamine 4-(4-Amino-2,3,5,6-tetrafluoro-phenyl)-2,3,5,6-tetrafluoro-aniline 2,2 inverted exclamation mark ,3,3 inverted exclamation mark ,5,5 inverted exclamation mark ,6,6 inverted exclamation mark -Octafluoro-[1,1 inverted exclamation mark -biphenyl]-4,4 inverted exclamation mark -diamine |
| Molecular Formula | C12H4F8N2 |
| Molecular Weight | 328.16 |
| InChI | InChI=1S/C12H4F8N2/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16/h21-22H2 |
| InChI Key | FWOLORXQTIGHFX-UHFFFAOYSA-N |
| Isomeric SMILES | C1(=C(C(=C(C(=C1F)F)N)F)F)C2=C(C(=C(C(=C2F)F)N)F)F |
| Patent Information | ||
| Patent ID | Title | Publication Date |
| CN114195688 | Diamine compound, resin, photosensitive resin composition, and cured film | 2022 |
Physical Data
| Appearance | Off-white solid powder |
| Melting Point, °C | Solvent (Melting Point) |
| 173 – 175 | |
| 175 – 176.5 | |
| 181 – 181.5 | benzene |
| 173 – 174 | petroleum ether |
| Density, g·cm-3 |
| 1.876 |
Spectra
| Description (NMR Spectroscopy) | Nucleus (NMR Spectroscopy) | Solvents (NMR Spectroscopy) | Temperature (NMR Spectroscopy), °C |
| Chemical shifts | 1H | chloroform-d1 | |
| Chemical shifts | 19F | chloroform-d1 | |
| Chemical shifts | 19F | dimethylsulfoxide-d6 | 22 |
| Description (IR Spectroscopy) | Solvent (IR Spectroscopy) |
| Fine structure of IR bands | |
| Spectrum | KBr |
| Fermi resonance | |
| Bands |
| Description (UV/VIS Spectroscopy) |
| Absorption maxima |
Route of Synthesis (ROS)
| Conditions | Yield |
| With pyridine In tetrahydrofuran for 12h; Cooling with ice; Experimental Procedure In an ice-water bath, dissolve 32.817g (100mmol) of 4,4′-diaminooctafluorobiphenyl in 300mL of tetrahydrofuran, then add 16.5mL (200mmol) of pyridine solution, after dissolving, slowly add 50.712g dropwise (200mmol) of 4-nitro-2-trifluoromethyl benzoyl chloride, after the dripping is completed, the reaction is fully stirred for 12h to produce a precipitate; the precipitate is filtered, thoroughly washed with tetrahydrofuran and deionized water, and then The precipitate was dried under reduced pressure at 100°C for 12 hours, and pulverized to obtain a solid powder (yield 87.1%), which is the nitro compound of the diamine precursor represented by formula (3); | 87.1% |
Safety and Hazards
| Pictogram(s) |  |
| Signal | Warning |
| GHS Hazard Statements | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (97.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
| Precautionary Statement Codes | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (The corresponding statement to each P-code can be found at the GHS Classification page.) |
Other Data
| Druglikeness | |
| Lipinski rules component | |
| Molecular Weight | 328.164 |
| logP | 3.616 |
| HBA | 2 |
| HBD | 2 |
| Matching Lipinski Rules | 4 |
| Veber rules component | |
| Polar Surface Area (PSA) | 52.04 |
| Rotatable Bond (RotB) | 1 |
| Matching Veber Rules | 2 |
| Use Pattern |
| 4,4′-Diaminooctafluorobiphenyl is commonly used in the synthesis of high-performance polyimides. These polyimides exhibit excellent thermal stability, mechanical properties, and chemical resistance, making them suitable for aerospace, electronics, and high-temperature environments. It is also used in the synthesis of polyaryletherketones, which are high-strength, chemically resistant, and high-temperature-resistant materials suitable for high-performance engineering plastics. 4,4′-Diaminooctafluorobiphenyl is used in the production of alignment layer materials for liquid crystal displays, improving display performance and stability. Semiconductor Materials: It is used in the semiconductor industry for photoresists and other electronic materials, providing excellent thermal stability and chemical resistance. Coatings and Adhesives Due to its excellent thermal stability and chemical resistance, 4,4′-Diaminooctafluorobiphenyl is used in the production of high-temperature coatings, suitable for protective coatings in high-temperature environments. High-Performance Adhesives: It is used in the manufacture of high-performance adhesives, offering superior bonding performance and chemical resistance, suitable for aerospace and electronics industries. |
Buy Reagent | |
| No reagent supplier? | Send quick inquiry to ChemWhat |
| Want to be listed here as a reagent supplier? (Paid service) | Click here to contact ChemWhat |
Approved Manufacturers | |
| Caming Pharmaceutical Limited | http://www.caming.com/ |
| Want to be listed as an approved manufacturer (Requires approvement)? | Please download and fill out this form and send back to approved-manufacturers@chemwhat.com |
Other Suppliers | |
| Watson International Limited | Visit Watson Official Website |
Contact Us for Other Help | |
| Contact us for other information or services | Click here to contact ChemWhat |