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Cas Database |
| Name |
2-Thiazolamine,4-(4-fluorophenyl)-5-methyl- |
EINECS | N/A |
| CAS No. | 2928-00-9 | Density | 1.3 g/cm3 |
| PSA | 67.15000 | LogP | 3.42100 |
| Solubility | N/A | Melting Point |
127 °C |
| Formula | C10H9FN2S | Boiling Point | 346.5 °C at 760 mmHg |
| Molecular Weight | 208.259 | Flash Point | 163.4 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | 39 | Risk Codes | 41-22 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
Thiazole,2-amino-4-(p-fluorophenyl)-5-methyl- (7CI,8CI);[4-(4-Fluorophenyl)-5-methylthiazol-2-yl]amine; |
Article Data | 3 |
2-Thiazolamine,4-(4-fluorophenyl)-5-methyl- Specification
The 2-Thiazolamine,4-(4-fluorophenyl)-5-methyl- is an organic compound with the formula C10H9FN2S. The IUPAC name of this chemical is 4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-amine. With the CAS registry number 2928-00-9, it is also named as 4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-ylamine. Besides, its molecular weight is 208.26.
The physical properties of 2-Thiazolamine,4-(4-fluorophenyl)-5-methyl- are: (1)ACD/LogP: 2.53; (2)ACD/LogD (pH 5.5): 2.3; (3)ACD/LogD (pH 7.4): 2.53; (4)ACD/BCF (pH 5.5): 28.68; (5)ACD/BCF (pH 7.4): 48.95; (6)ACD/KOC (pH 5.5): 329.51; (7)ACD/KOC (pH 7.4): 562.36; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 44.37 Å2; (12)Index of Refraction: 1.621; (13)Molar Refractivity: 56.37 cm3; (14)Molar Volume: 160.1 cm3; (15)Polarizability: 22.34×10-24 cm3; (16)Surface Tension: 51.2 dyne/cm; (17)Density: 1.3 g/cm3; (18)Flash Point: 163.4 °C; (19)Enthalpy of Vaporization: 59.07 kJ/mol; (20)Boiling Point: 346.5 °C at 760 mmHg; (21)Vapour Pressure: 5.72E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc2ccc(c1nc(sc1C)N)cc2
(2)InChI: InChI=1/C10H9FN2S/c1-6-9(13-10(12)14-6)7-2-4-8(11)5-3-7/h2-5H,1H3,(H2,12,13)
(3)InChIKey: KPOAMSWZRRKBHN-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C10H9FN2S/c1-6-9(13-10(12)14-6)7-2-4-8(11)5-3-7/h2-5H,1H3,(H2,12,13)
(5)Std. InChIKey: KPOAMSWZRRKBHN-UHFFFAOYSA-N
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