Product Name

  • Name

    2-(4-Methyl-5-thiazolyl)ethyl decanoate

  • EINECS
  • CAS No. 101426-31-7
  • Density 1.026 g/cm3
  • Solubility
  • Melting Point
  • Formula C16H27NO2S
  • Boiling Point 396.8 °C at 760 mmHg
  • Molecular Weight 297.49
  • Flash Point 193.8 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 101426-31-7 (2-(4-Methyl-5-thiazolyl)ethyl decanoate)
  • Hazard Symbols
  • Synonyms 2-(4-Methyl-5-thiazolyl)ethyl decanoate;
  • PSA 67.43000
  • LogP 4.67790

2-(4-Methyl-5-thiazolyl)ethyl decanoate Specification

The 2-(4-Methyl-5-thiazolyl)ethyl decanoate with the CAS number 101426-31-7 is also called Decanoic acid,2-(4-methyl-5-thiazolyl)ethyl ester. Its molecular formula is C16H27NO2S. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 2-(4-Methyl-5-thiazolyl)ethyl decanoate are: (1)ACD/LogP: 5.23; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.23; (4)ACD/LogD (pH 7.4): 5.23; (5)#H bond acceptors: 3; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 12; (8)Polar Surface Area: 67.43 Å2; (9)Index of Refraction: 1.499; (10)Molar Refractivity: 85.2 cm3; (11)Molar Volume: 289.7 cm3; (12)Polarizability: 33.77×10-24cm3; (13)Surface Tension: 38.4 dyne/cm; (14)Enthalpy of Vaporization: 64.72 kJ/mol; (15)Vapour Pressure: 1.66×10-6 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ncsc1CCOC(=O)CCCCCCCCC
(2)InChI: InChI=1/C16H27NO2S/c1-3-4-5-6-7-8-9-10-16(18)19-12-11-15-14(2)17-13-20-15/h13H,3-12H2,1-2H3
(3)InChIKey: RUOLKIITSCGKJQ-UHFFFAOYAZ

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