Basic Information | Post buying leads | Suppliers |
Name |
1,2,3-Thiadiazol-5-amine,4-(4-chlorophenyl)- |
EINECS | N/A |
CAS No. | 388088-77-5 | Density | 1.461 g/cm3 |
PSA | 80.04000 | LogP | 3.02190 |
Solubility | N/A | Melting Point |
148.8℃ |
Formula | C8H6ClN3S | Boiling Point | 368.9 °C at 760 mmHg |
Molecular Weight | 211.67 | Flash Point | 176.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes |
Xi:Irritant; |
|
Molecular Structure | Hazard Symbols | R36/37/38:Irritating to eyes, respiratory system and skin.; | |
Synonyms |
4-(4-CHLOROPHENYL)-1,2,3-THIADIAZOL-5-AMINE;4-(4-Chlorophenyl)-1,2,3-thiadiazol-5-amine ,97%;5-Amino-4-(4-chlorophenyl)-1,2,3-thiadiazole |
The 1,2,3-Thiadiazol-5-amine,4-(4-chlorophenyl)- is an organic compound with the formula C8H6ClN3S. With the CAS registry number 388088-77-5, the systematic name of this chemical is 4-(4-chlorophenyl)-1,2,3-thiadiazol-5-amine.
Physical properties about 1,2,3-Thiadiazol-5-amine,4-(4-chlorophenyl)- are: (1)ACD/LogP: 1.82; (2)ACD/LogD (pH 5.5): 1.82; (3)ACD/LogD (pH 7.4): 1.82; (4)ACD/BCF (pH 5.5): 14.3; (5)ACD/BCF (pH 7.4): 14.3; (6)ACD/KOC (pH 5.5): 233.62; (7)ACD/KOC (pH 7.4): 233.62; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 57.26 Å2; (12)Index of Refraction: 1.676; (13)Molar Refractivity: 54.54 cm3; (14)Molar Volume: 144.8 cm3; (15)Polarizability: 21.62×10-24cm3; (16)Surface Tension: 66.5 dyne/cm; (17)Density: 1.461 g/cm3; (18)Flash Point: 176.9 °C; (19)Enthalpy of Vaporization: 61.56 kJ/mol; (20)Boiling Point: 368.9 °C at 760 mmHg; (21)Vapour Pressure: 1.24E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccc(c1nnsc1N)cc2
(2)InChI: InChI=1/C8H6ClN3S/c9-6-3-1-5(2-4-6)7-8(10)13-12-11-7/h1-4H,10H2
(3)InChIKey: CWWWFWUOEYNACY-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C8H6ClN3S/c9-6-3-1-5(2-4-6)7-8(10)13-12-11-7/h1-4H,10H2
(5)Std. InChIKey: CWWWFWUOEYNACY-UHFFFAOYSA-N