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Cas Database |
| Name |
Ethanamine,2,2-difluoro- (9CI) |
EINECS | N/A |
| CAS No. | 430-67-1 | Density | 1.059 g/cm3 |
| PSA | 26.02000 | LogP | 0.91050 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C2H5F2N | Boiling Point | 59.4 °C at 760 mmHg |
| Molecular Weight | 81.0652 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | 26-36/37/39 | Risk Codes | 34 |
| Molecular Structure |
|
Hazard Symbols |
 C, Xi
|
| Synonyms |
Ethylamine,2,2-difluoro- (7CI,8CI);2,2-Difluoroethylamine;2,2-Difluoroethanamine; |
Article Data | 11 |
Ethanamine,2,2-difluoro- (9CI) Synthetic route
| Conditions | Yield |
|---|---|
| With ammonium hydroxide at 160℃; under 22502.3 Torr; for 2h; Temperature; Pressure; Large scale; | 90% |
| With ammonia; potassium iodide In 1-Methylpyrrolidine at 143 - 145℃; for 5.5h; Product distribution / selectivity; Autoclave; | 88% |
| With ammonium hydroxide; 18-crown-6 ether; potassium iodide In dimethyl sulfoxide Autoclave; | 79% |
- 1184224-96-1
N-benzyl-2,2-difluoroethanamine
- 430-67-1
2,2-difluorethylamine
| Conditions | Yield |
|---|---|
| With hydrogen; 5%-palladium/activated carbon In toluene at 80℃; under 4500.45 Torr; for 10h; Inert atmosphere; | 84% |
| Conditions | Yield |
|---|---|
| With ammonia; potassium iodide In dimethyl sulfoxide at 100℃; for 1h; Product distribution / selectivity; Autoclave; | 82% |
| With ammonia; water at 125℃; | |
| With ammonia In neat (no solvent) at 160℃; Temperature; |
- 1178819-40-3
N-(2,2-difluoroethyl)prop-2-en-1-amine
- 430-67-1
2,2-difluorethylamine
| Conditions | Yield |
|---|---|
| With ethanolamine; palladium 10% on activated carbon at 90℃; | 68% |
| Conditions | Yield |
|---|---|
| With sodium tetrahydroborate; boron trifluoride diethyl etherate | 60% |
- 359-07-9
2-bromo-1,1-difluoroethane
A
- 430-67-1
2,2-difluorethylamine
B
- 462-89-5
bis-(2,2-difluoro-ethyl)-amine
| Conditions | Yield |
|---|---|
| With ethanol; ammonia at 125 - 145℃; |
- 93630-44-5
(1R,2S,3R,4S)-3-(2,2-Difluoro-ethylcarbamoyl)-bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
A
- 430-67-1
2,2-difluorethylamine
B
- 129-64-6
3,6-endomethylene-1,2,3,6-tetrahydrophthalic anhydride
| Conditions | Yield |
|---|---|
| With water at 38℃; Rate constant; |
| Conditions | Yield |
|---|---|
| With water at 38℃; Rate constant; |
- 946000-58-4
methanesulfonic acid 2-[3-(tert-butyl-dimethyl-silanyloxymethyl)-4-chloro-phenyl]-ethyl ester
- 430-67-1
2,2-difluorethylamine
| Conditions | Yield |
|---|---|
| In ethanol at 60℃; | 100% |
| In ethanol at 60℃; |
- 430-67-1
2,2-difluorethylamine
- 95-49-8
2-methylchlorobenzene
- 2366-95-2
N-(2,2-difluoro-ethyl)-o-toluidine
| Conditions | Yield |
|---|---|
| With bis(η3-allyl-μ-chloropalladium(II)); 5-(di(adamantan-1-yl)phosphino)-1′,3′,5′-triphenyl-1′H-1,4′-bipyrazole; potassium phenolate In 1,4-dioxane at 100℃; for 6h; Sealed tube; Inert atmosphere; | 99% |
| With copper(I) oxide; copper |
Ethanamine,2,2-difluoro- (9CI) Specification
The Ethanamine,2,2-difluoro- (9CI), with the CAS registry number 430-67-1, is also known as Ethylamine,2,2-difluoro- (7CI,8CI). This chemical's molecular formula is C2H5F2N and molecular weight is 81.0646. What's more, both its IUPAC name and systematic name are the same which is called 2,2-Difluoroethanamine.
Physical properties about Ethanamine,2,2-difluoro- (9CI) are: (1)ACD/LogP: -0.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.98; (4)ACD/LogD (pH 7.4): -0.57; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 9.75; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.319; (14)Molar Refractivity: 15.13 cm3; (15)Molar Volume: 76.4 cm3; (16)Polarizability: 6×10-24 cm3; (17)Surface Tension: 17.8 dyne/cm; (18)Density: 1.059 g/cm3; (19)Enthalpy of Vaporization: 30.2 kJ/mol; (20)Boiling Point: 59.4 °C at 760 mmHg; (21)Vapour Pressure: 201 mmHg at 25 °C.
When you are dealing with this chemical, you should be very careful. This chemical causes burns. During using it, you should wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)CN
(2) InChI: InChI=1/C2H5F2N/c3-2(4)1-5/h2H,1,5H2
(3) InChIKey: OVRWUZYZECPJOB-UHFFFAOYAO
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