Basic Information | Post buying leads | Suppliers |
Name |
5-Chloro-6-methyl-1,3-benzothiazol-2-amine |
EINECS | N/A |
CAS No. | 50850-98-1 | Density | 1.452 g/cm3 |
PSA | 67.15000 | LogP | 3.42150 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H7ClN2S | Boiling Point | 356.2 °C at 760 mmHg |
Molecular Weight | 198.676 | Flash Point | 169.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Benzothiazolamine,5-chloro-6-methyl-(9CI); |
The 5-Chloro-6-methyl-1,3-benzothiazol-2-amine is an organic compound with the formula C8H7ClN2S. The systematic name of this chemical is 5-chloro-6-methyl-1,3-benzothiazol-2-amine. With the CAS registry number 50850-98-1, it is also named as 2-Benzothiazolamine, 5-chloro-6-methyl-. The product's category is Benzothiazole.
Physical properties about 5-Chloro-6-methyl-1,3-benzothiazol-2-amine are: (1)CD/LogP: 2.95; (2)ACD/LogD (pH 5.5): 2.94; (3)ACD/LogD (pH 7.4): 2.95; (4)ACD/BCF (pH 5.5): 100.25; (5)ACD/BCF (pH 7.4): 102.24; (6)ACD/KOC (pH 5.5): 936.55; (7)ACD/KOC (pH 7.4): 955.13; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)Polar Surface Area: 44.37 Å2; (11)Index of Refraction: 1.728; (12)Molar Refractivity: 54.52 cm3; (13)Molar Volume: 136.7 cm3; (14)Polarizability: 21.61×10-24cm3; (15)Surface Tension: 64.6 dyne/cm; (16)Density: 1.452 g/cm3; (17)Flash Point: 169.2 °C; (18)Enthalpy of Vaporization: 60.15 kJ/mol; (19)Boiling Point: 356.2 °C at 760 mmHg; (20)Vapour Pressure: 2.96E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc2nc(sc2cc1C)N
(2)InChI: InChI=1/C8H7ClN2S/c1-4-2-7-6(3-5(4)9)11-8(10)12-7/h2-3H,1H3,(H2,10,11)
(3)InChIKey: FFWBEOJHVGXEMJ-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C8H7ClN2S/c1-4-2-7-6(3-5(4)9)11-8(10)12-7/h2-3H,1H3,(H2,10,11)
(5)Std. InChIKey: FFWBEOJHVGXEMJ-UHFFFAOYSA-N