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| CAS No.: | 175277-93-7 |
|---|---|
| Name: | 2-AMINO-6-FLUOROBENZYLAMINE |
| Molecular Structure: | |
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|
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| Formula: | C7H9FN2 |
| Molecular Weight: | 140.16 |
| Synonyms: | 2-Amino-6-fluorobenzylamine;2-Aminomethyl-3-fluorophenylamine; |
| Density: | 1.209 g/cm3 |
| Boiling Point: | 265 °C at 760 mmHg |
| Flash Point: | 117.4 °C |
| Appearance: | colorless liquid |
| Hazard Symbols: |
 C
|
| Risk Codes: | 34 |
| Safety: | 26-27-36/37/39-45 |
| Transport Information: | UN 2735 |
| PSA: | 52.04000 |
| LogP: | 2.14810 |
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Specification
This chemical is called Benzenemethanamine, 2-amino-6-fluoro-, and its CAS registry number is 175277-93-7. With the molecular formula of C7H9FN2, its product categories are Amines and Anilines; API intermediates; Nitrogen Compounds; Organic Building Blocks; Polyamines. In addition, this chemical should be sealed in the cool and dry place, away from oxides, air and acid.
Other characteristics of the Benzenemethanamine, 2-amino-6-fluoro- can be summarised as followings: (1)ACD/LogP: 0.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.76; (4)ACD/LogD (pH 7.4): -1.6; (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): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 6.48 Å2; (13)Index of Refraction: 1.586; (14)Molar Refractivity: 38.93 cm3; (15)Molar Volume: 115.9 cm3; (16)Polarizability: 15.43×10-24cm3; (17)Surface Tension: 48.6 dyne/cm; (18)Density: 1.209 g/cm3; (19)Flash Point: 117.4 °C; (20)Enthalpy of Vaporization: 50.29 kJ/mol; (21)Boiling Point: 265 °C at 760 mmHg; (22)Vapour Pressure: 0.00939 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical causes burns. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: Fc1cccc(N)c1CN
2.InChI: InChI=1/C7H9FN2/c8-6-2-1-3-7(10)5(6)4-9/h1-3H,4,9-10H2
3.InChIKey: KBIXYFABFIYSAU-UHFFFAOYAW