Products Categories
CAS No.: | 29947-24-8 |
---|---|
Name: | 2-Bromo-4,5-dimethyl-1,3-thiazole |
Molecular Structure: | |
Formula: | C5H6BrNS |
Molecular Weight: | 192.079 |
Synonyms: | 2-Bromo-4,5-dimethylthiazole;2-bromo-4,5-dimethyl-1,3-thiazole; |
Density: | 1.589 g/cm3 |
Melting Point: | 31.5-32.0 °C |
Boiling Point: | 223.115 °C at 760 mmHg |
Flash Point: | 88.737 °C |
PSA: | 41.13000 |
LogP: | 2.52240 |
What can I do for you?
Get Best Price
The Thiazole, 2-bromo-4,5-dimethyl-, with the CAS registry number 29947-24-8, has the systematic name of 2-bromo-4,5-dimethyl-1,3-thiazole. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C5H6BrNS.
The characteristics of Thiazole, 2-bromo-4,5-dimethyl- are as followings: (1)ACD/LogP: 2.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 86; (6)ACD/BCF (pH 7.4): 86; (7)ACD/KOC (pH 5.5): 843; (8)ACD/KOC (pH 7.4): 844; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 41.13 Å2; (13)Index of Refraction: 1.577; (14)Molar Refractivity: 40.068 cm3; (15)Molar Volume: 120.872 cm3; (16)Polarizability: 15.884×10-24cm3; (17)Surface Tension: 43.471 dyne/cm; (18)Density: 1.589 g/cm3; (19)Flash Point: 88.737 °C; (20)Enthalpy of Vaporization: 44.089 kJ/mol; (21)Boiling Point: 223.115 °C at 760 mmHg; (22)Vapour Pressure: 0.146 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Brc1nc(c(s1)C)C
(2)InChI: InChI=1/C5H6BrNS/c1-3-4(2)8-5(6)7-3/h1-2H3
(3)InChIKey: SOFNZMRISCENSZ-UHFFFAOYAN