2-Thiazolamine,4-(4-fluorophenyl)-5-methyl- supplier

Name
4-(4-FLUORO-PHENYL)-5-METHYL-THIAZOL-2-YLAMINE
EINECS
CAS No. 2928-00-9
Article Data3
CAS DataBase
Density 1.3 g/cm³
Solubility
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
Appearance
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;
PSA 67.15000
LogP 3.42100

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

Product Name

4-(4-FLUORO-PHENYL)-5-METHYL-THIAZOL-2-YLAMINE

2-Thiazolamine,4-(4-fluorophenyl)-5-methyl- Specification

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