Basic Information | Post buying leads | Suppliers |
Name |
2-Benzothiazolemethanol,6-fluoro- |
EINECS | N/A |
CAS No. | 197364-68-4 | Density | 1.474 g/cm3 |
PSA | 61.36000 | LogP | 1.92770 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H6FNOS | Boiling Point | 303.7 °C at 760 mmHg |
Molecular Weight | 183.21 | Flash Point | 137.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(6-Fluoro-1,3-benzothiazol-2-yl)methanol;(6-Fluorobenzo[d]thiazol-2-yl)methanol; |
The 2-Benzothiazolemethanol,6-fluoro-, with the CAS registry number 197364-68-4, is also known as (6-Fluorobenzo[d]thiazol-2-yl)methanol. It belongs to the product category of Benzothiazole. This chemical's molecular formula is C8H6FNOS and molecular weight is 183.21. What's more, its systematic name is (6-fluoro-1,3-benzothiazol-2-yl)methanol.
Physical properties of 2-Benzothiazolemethanol,6-fluoro- are: (1)ACD/LogP: 1.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.66; (4)ACD/LogD (pH 7.4): 1.66; (5)ACD/BCF (pH 5.5): 10.79; (6)ACD/BCF (pH 7.4): 10.79; (7)ACD/KOC (pH 5.5): 191.05; (8)ACD/KOC (pH 7.4): 191.06; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 61.36 Å2; (13)Index of Refraction: 1.68; (14)Molar Refractivity: 47.01 cm3; (15)Molar Volume: 124.2 cm3; (16)Polarizability: 18.63×10-24cm3; (17)Surface Tension: 62.2 dyne/cm; (18)Density: 1.474 g/cm3; (19)Flash Point: 137.4 °C; (20)Enthalpy of Vaporization: 57.44 kJ/mol; (21)Boiling Point: 303.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000404 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc2nc(CO)sc2c1
(2)InChI: InChI=1/C8H6FNOS/c9-5-1-2-6-7(3-5)12-8(4-11)10-6/h1-3,11H,4H2
(3)InChIKey: JFMAENBYNXKRTD-UHFFFAOYAI