Product Name

  • Name

    5-ISOXAZOLEMETHANOL

  • EINECS
  • CAS No. 127232-41-1
  • Article Data17
  • CAS DataBase
  • Density 1.25 g/cm3
  • Solubility
  • Melting Point
  • Formula C4H5NO2
  • Boiling Point 212.785 °C at 760 mmHg
  • Molecular Weight 99.0892
  • Flash Point 82.49 °C
  • Transport Information
  • Appearance
  • Safety 26-39
  • Risk Codes  Xi:Irritant;
  • Molecular Structure Molecular Structure of 127232-41-1 (5-ISOXAZOLEMETHANOL)
  • Hazard Symbols IrritantXi
  • Synonyms 5-(Hydroxymethyl)oxazole;Oxazol-5-ylmethanol;5-Oxazolemethanol;
  • PSA 46.26000
  • LogP 0.16690

Oxazole-5-methanol Specification

The Oxazole-5-methanol with the CAS number 127232-41-1 is also called 5-(Hydroxymethyl)oxazole. The systematic name is 1,3-oxazol-5-ylmethanol. Its molecular formula is C4H5NO2. This chemical belongs to the following product categories: (1)blocks; (2)Oxazoles. It is irritant. While using this chemical, you should be very cautious.

The properties of the chemical are: (1)ACD/LogP: -0.78; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 6; (6)ACD/KOC (pH 7.4): 6; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 46.26 Å2; (11)Index of Refraction: 1.494; (12)Molar Refractivity: 23.095 cm3; (13)Molar Volume: 79.268 cm3; (14)Polarizability: 9.156×10-24cm3; (15)Surface Tension: 48.274 dyne/cm; (16)Enthalpy of Vaporization: 47.473 kJ/mol; (17)Vapour Pressure: 0.101 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OCc1cnco1
(2)InChI: InChI=1/C4H5NO2/c6-2-4-1-5-3-7-4/h1,3,6H,2H2
(3)InChIKey: CRPXMLXYMBLZEP-UHFFFAOYAS

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