Product Name

  • Name

    2,5-DIBROMO-4-METHYLTHIAZOLE

  • EINECS
  • CAS No. 79247-78-2
  • Article Data3
  • CAS DataBase
  • Density 2.127 g/cm3
  • Solubility
  • Melting Point 22 °C
  • Formula C4H3Br2NS
  • Boiling Point 260.735 °C at 760 mmHg
  • Molecular Weight 256.94632
  • Flash Point 111.489 °C
  • Transport Information
  • Appearance
  • Safety 26-39-45
  • Risk Codes 25-41
  • Molecular Structure Molecular Structure of 79247-78-2 (2,5-DIBROMO-4-METHYLTHIAZOLE)
  • Hazard Symbols T
  • Synonyms 2,5-Dibromo-4-methylthiazole;
  • PSA 41.13000
  • LogP 2.97650

2,5-Dibromo-4-methylthiazole Specification

The Thiazole,2,5-dibromo-4-methyl-, with the CAS registry number of 79247-78-2, is also known as 2,5-Dibromo-4-methylthiazole. It belongs to the product categories of Thiazole; Building Blocks. Its molecular formula is C4H3Br2NS and molecular weight is 256.94632. What's more, its IUPAC name is 2,5-Dibromo-4-methyl-1,3-thiazole.

Physical properties about the Thiazole,2,5-dibromo-4-methyl- are: (1)ACD/LogP: 2.84; (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): 148; (6)ACD/BCF (pH 7.4): 148; (7)ACD/KOC (pH 5.5): 1247; (8)ACD/KOC (pH 7.4): 1247; (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: 1.629; (14)Molar Refractivity: 42.934 cm3; (15)Molar Volume: 120.781 cm3; (16)Surface Tension: 51.283 dyne/cm; (17)Density: 2.127 g/cm3; (18)Flash Point: 111.489 °C; (19)Enthalpy of Vaporization: 47.832 kJ/mol; (20)Boiling Point: 260.735 °C at 760 mmHg; (21)Vapour Pressure: 0.02 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1sc(Br)nc1C
(2) InChI: InChI=1/C4H3Br2NS/c1-2-3(5)8-4(6)7-2/h1H3
(3) InChIKey: PVJMZIKWTNQXKO-UHFFFAOYAK

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