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| CAS No.: | 65373-52-6 |
|---|---|
| Name: | Oxazole-2-carbaldehyde |
| Article Data: | 9 |
| Molecular Structure: | |
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| Formula: | C4H3NO2 |
| Molecular Weight: | 97.0733 |
| Synonyms: | 1,3-Oxazole-2-carboxaldehyde; |
| Density: | 1.259 g/cm3 |
| Boiling Point: | 182.546 °C at 760 mmHg |
| Flash Point: | 64.202 °C |
| Hazard Symbols: |
 Xi;  F
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 43.10000 |
| LogP: | 0.48710 |
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Specification
The Oxazole-2-carbaldehyde, with the CAS registry number 65373-52-6, is also known as 2-Oxazolecarboxaldehyde. It belongs to the product categories of Aldehyde; Aldehydes; Oxazoles, Isoxazoles & Benzoxazoles; Oxazoles, Isoxazoles & Benzoxazoles. This chemical's molecular formula is C4H3NO2 and molecular weight is 97.07212. Its IUPAC name is called 1,3-oxazole-2-carbaldehyde.
Physical properties of Oxazole-2-carbaldehyde: (1)ACD/LogP: 0.12; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 28; (5)ACD/KOC (pH 7.4): 28; (6)#H bond acceptors: 3; (7)#Freely Rotating Bonds: 1; (8)Index of Refraction: 1.519; (9)Molar Refractivity: 23.397 cm3; (10)Molar Volume: 77.118 cm3; (11)Surface Tension: 45.655 dyne/cm; (12)Density: 1.259 g/cm3; (13)Flash Point: 64.202 °C; (14)Enthalpy of Vaporization: 40.163 kJ/mol; (15)Boiling Point: 182.546 °C at 760 mmHg; (16)Vapour Pressure: 1.099 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 may catch fire in contact with air and only need brief contact with an ignition source which has a very low flash point or evolve highly flammable gases in contact with water. 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)Canonical SMILES: C1=COC(=N1)C=O
(2)InChI: InChI=1S/C4H3NO2/c6-3-4-5-1-2-7-4/h1-3H
(3)InChIKey: TYHOSUCCUICRLM-UHFFFAOYSA-N