Product Name

  • Name

    2-(4-TRIFLUOROMETHOXYPHENYL)MALONDIALDEHYDE

  • EINECS 942-848-2
  • CAS No. 493036-48-9
  • Density 1.33 g/cm3
  • Solubility
  • Melting Point 96-98°C
  • Formula C10H7F3O3
  • Boiling Point 244 °C at 760 mmHg
  • Molecular Weight 232.16
  • Flash Point 98.5 °C
  • Transport Information
  • Appearance
  • Safety 26-36/37/39
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 493036-48-9 (2-(4-TRIFLUOROMETHOXYPHENYL)MALONDIALDEHYDE)
  • Hazard Symbols IrritantXi
  • Synonyms Propanedial,[4-(trifluoromethoxy)phenyl]- (9CI);
  • PSA 43.37000
  • LogP 2.06660

Propanedial,2-[4-(trifluoromethoxy)phenyl]- Specification

The CAS registry number of Propanedial,2-[4-(trifluoromethoxy)phenyl]- is 493036-48-9. This chemical is also named as 2-(4-Trifluoromethoxyphenyl)malondialdehyde. In addition, its molecular formula is C10H7F3O3 and molecular weight is 232.16. Its systematic name is called [4-(trifluoromethoxy)phenyl]propanedial.

Physical properties about Propanedial,2-[4-(trifluoromethoxy)phenyl]- are: (1)ACD/LogP: 2.86; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Index of Refraction: 1.461; (7)Molar Refractivity: 47.94 cm3; (8)Molar Volume: 174.5 cm3; (9)Surface Tension: 33.6 dyne/cm; (10)Density: 1.33 g/cm3; (11)Flash Point: 98.5 °C; (12)Enthalpy of Vaporization: 48.11 kJ/mol; (13)Boiling Point: 244 °C at 760 mmHg; (14)Vapour Pressure: 0.031 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)Oc1ccc(cc1)C(C=O)C=O
(2)InChI: InChI=1/C10H7F3O3/c11-10(12,13)16-9-3-1-7(2-4-9)8(5-14)6-15/h1-6,8H
(3)InChIKey: XPCIZTVZSLNGCF-UHFFFAOYAW

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