4-Bromo-2-methylthiazole supplier

Name
4-BROMO-2-METHYLTHIAZOLE
EINECS
CAS No. 298694-30-1
Article Data7
CAS DataBase
Density 1.702 g/cm³
Solubility
Melting Point
Formula C₄H₄BrNS
Boiling Point 199.2 °C at 760 mmHg
Molecular Weight 178.052
Flash Point 74.3 °C
Transport Information
Appearance
Safety 26-39
Risk Codes 41
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Bromo-2-methylthiazole;
PSA 41.13000
LogP 2.21400

4-Bromo-2-methylthiazole Specification

The Thiazole, 4-bromo-2-methyl-, with the CAS registry number 298694-30-1, is also known as 4-Bromo-2-methylthiazole. This chemical's molecular formula is C₄H₄BrNS and molecular weight is 178.05. What's more, its systematic name is 4-Bromo-2-methyl-1, 3-thiazole. In addition, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about Thiazole, 4-bromo-2-methyl- are: (1)ACD/LogP: 1.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.87; (4)ACD/LogD (pH 7.4): 1.87; (5)ACD/BCF (pH 5.5): 15.62; (6)ACD/BCF (pH 7.4): 15.62; (7)ACD/KOC (pH 5.5): 248.92; (8)ACD/KOC (pH 7.4): 248.96; (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: 1.588; (14)Molar Refractivity: 35.24 cm³; (15)Molar Volume: 104.5 cm³; (16)Polarizability: 13.97×10^-24 cm³; (17)Surface Tension: 46.2 dyne/cm; (18)Density: 1.702 g/cm³; (19)Flash Point: 74.3 °C; (20)Enthalpy of Vaporization: 41.76 kJ/mol; (21)Boiling Point: 199.2 °C at 760 mmHg; (22)Vapour Pressure: 0.488 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1nc(sc1)C
(2) InChI: InChI=1/C4H4BrNS/c1-3-6-4(5)2-7-3/h2H,1H3
(3) InChIKey: LYRXILTUZBBMNS-UHFFFAOYAU

Product Name

4-BROMO-2-METHYLTHIAZOLE

4-Bromo-2-methylthiazole Specification

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