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

Name
4-(4-CHLOROPHENYL)-1,2,3-THIADIAZOL-5-AMINE
EINECS
CAS No. 388088-77-5
Density 1.461 g/cm³
Solubility
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
Appearance
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
PSA 80.04000
LogP 3.02190

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

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

Product Name

4-(4-CHLOROPHENYL)-1,2,3-THIADIAZOL-5-AMINE

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

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