Product Name

  • Name

    4-(4-Methylphenyl)-2thiazolecarboxaldehyde

  • EINECS
  • CAS No. 383143-86-0
  • Density 1.229 g/cm3
  • Solubility
  • Melting Point
  • Formula C11H9NOS
  • Boiling Point 372.451 °C at 760 mmHg
  • Molecular Weight 203.26
  • Flash Point 179.052 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 383143-86-0 (4-(4-Methylphenyl)-2thiazolecarboxaldehyde)
  • Hazard Symbols
  • Synonyms 4-p-Tolylthiazole-2-carbaldehyde;4-(4-Methylphenyl)-1,3-thiazole-2-carbaldehyde;
  • PSA 58.20000
  • LogP 2.93100

4-(4-Methylphenyl)-2-thiazolecarboxaldehyde Specification

The 4-(4-Methylphenyl)-2-thiazolecarboxaldehyde, with the CAS registry number 383143-86-0, is also known as 4-p-Tolylthiazole-2-carbaldehyde. This chemical's molecular formula is C11H9NOS and molecular weight is 203.26. What's more, its systematic name is 4-(2-Chlorophenyl)-1,3-thiazole-2-carbaldehyde.

Physical properties of 4-(4-Methylphenyl)-2-thiazolecarboxaldehyde are: (1)ACD/LogP: 2.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.72; (4)ACD/LogD (pH 7.4): 2.72; (5)ACD/BCF (pH 5.5): 68.74; (6)ACD/BCF (pH 7.4): 68.74; (7)ACD/KOC (pH 5.5): 718.94; (8)ACD/KOC (pH 7.4): 718.94; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 58.2 Å2; (13)Index of Refraction: 1.631; (14)Molar Refractivity: 58.898 cm3; (15)Molar Volume: 165.362 cm3; (16)Polarizability: 23.349×10-24cm3; (17)Surface Tension: 50.4 dyne/cm; (18)Density: 1.229 g/cm3; (19)Flash Point: 179.052 °C; (20)Enthalpy of Vaporization: 59.527 kJ/mol; (21)Boiling Point: 372.451 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2nc(c1ccc(cc1)C)cs2
(2)Std. InChI: InChI=1S/C11H9NOS/c1-8-2-4-9(5-3-8)10-7-14-11(6-13)12-10/h2-7H,1H3
(3)Std. InChIKey: NIYYLXDRLQFYMS-UHFFFAOYSA-N 

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