1,3,4-Thiadiazol-2-amine,5-(4-fluorophenyl)- supplier

Name
2-AMINO-5-(4-FLUOROPHENYL)-1 3 4-THIADI&
EINECS
CAS No. 942-70-1
Article Data39
CAS DataBase
Density 1.423 g/cm³
Solubility
Melting Point 238-243 °C
Formula C₈H₆FN₃S
Boiling Point 351.9 °C at 760 mmHg
Molecular Weight 195.22
Flash Point 166.6 °C
Transport Information
Appearance
Safety 26
Risk Codes 22-36
Molecular Structure
Hazard Symbols Xn
Synonyms 1,3,4-Thiadiazole,2-amino-5-(p-fluorophenyl)- (7CI,8CI);2-Amino-5-(4-fluorophenyl)-1,3,4-thiadiazole;5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-amine;5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-ylamine;
PSA 80.04000
LogP 2.50760

1,3,4-Thiadiazol-2-amine,5-(4-fluorophenyl)- Specification

The 1,3,4-Thiadiazol-2-amine,5-(4-fluorophenyl)-, with the CAS registry number 942-70-1, is also known as 2-Amino-5-(4-fluorophenyl)-1,3,4-thiadiazole. It belongs to the product category of API intermediates. This chemical's molecular formula is C₈H₆FN₃S and molecular weight is 195.2167. Its systematic name is called 5-(4-fluorophenyl)-1,3,4-thiadiazol-2-amine.

Physical properties of 1,3,4-Thiadiazol-2-amine,5-(4-fluorophenyl)-: (1)ACD/LogP: 2.25; (2)ACD/LogD (pH 5.5): 2.25; (3)ACD/LogD (pH 7.4): 2.25; (4)ACD/BCF (pH 5.5): 30.18; (5)ACD/BCF (pH 7.4): 30.2; (6)ACD/KOC (pH 5.5): 398.77; (7)ACD/KOC (pH 7.4): 399; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.643; (12)Molar Refractivity: 49.64 cm³; (13)Molar Volume: 137.1 cm³; (14)Surface Tension: 62.1 dyne/cm; (15)Density: 1.423 g/cm³; (16)Flash Point: 166.6 °C; (17)Enthalpy of Vaporization: 59.67 kJ/mol; (18)Boiling Point: 351.9 °C at 760 mmHg; (19)Vapour Pressure: 3.98E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful if swallowed. In addition, it is irritating to eyes. 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: Fc2ccc(c1nnc(s1)N)cc2
(2)InChI: InChI=1/C8H6FN3S/c9-6-3-1-5(2-4-6)7-11-12-8(10)13-7/h1-4H,(H2,10,12)
(3)InChIKey: WRSVCKNLHZWSNJ-UHFFFAOYAT

Product Name

2-AMINO-5-(4-FLUOROPHENYL)-1 3 4-THIADI&

1,3,4-Thiadiazol-2-amine,5-(4-fluorophenyl)- Specification

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