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| CAS No.: | 19396-83-9 |
|---|---|
| Name: | NORBORNANE-2-CARBOXALDEHYDE |
| Article Data: | 18 |
| Molecular Structure: | |
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| Formula: | C8H12O |
| Molecular Weight: | 124.183 |
| Synonyms: | 2-Norbornanecarboxaldehyde(6CI,7CI,8CI);2-Formylbicyclo[2.2.1]heptane;2-Norbornanecarbaldehyde; |
| EINECS: | 243-025-4 |
| Density: | 1.11 g/cm3 |
| Boiling Point: | 182.5 °C at 760 mmHg |
| Flash Point: | 58.1 °C |
| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 17.07000 |
| LogP: | 1.62150 |
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Specification
The Bicyclo[2.2.1]heptane-2-carboxaldehyde, with the CAS registry number 19396-83-9, is also known as 2-Norbornyl ketone. It belongs to the product category of Pharmacetical. Its EINECS registry number is 243-025-4. This chemical's molecular formula is C8H12O and molecular weight is 124.1803. What's more, its IUPAC name is Bicyclo[2.2.1]heptane-3-carbaldehyde.
Physical properties about Bicyclo[2.2.1]heptane-2-carboxaldehyde are: (1)ACD/LogP: 1.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.76; (4)ACD/LogD (pH 7.4): 1.76; (5)ACD/BCF (pH 5.5): 12.74; (6)ACD/BCF (pH 7.4): 12.74; (7)ACD/KOC (pH 5.5): 215.18; (8)ACD/KOC (pH 7.4): 215.18; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.575; (14)Molar Refractivity: 36.94 cm3; (15)Molar Volume: 111.7 cm3; (16)Polarizability: 14.64×10-24 cm3; (17)Surface Tension: 41.5 dyne/cm; (18)Density: 1.11 g/cm3; (19)Flash Point: 58.1 °C; (20)Enthalpy of Vaporization: 41.87 kJ/mol; (21)Boiling Point: 182.5 °C at 760 mmHg; (22)Vapour Pressure: 0.81 mmHg at 25 °C.
Use of Bicyclo[2.2.1]heptane-2-carboxaldehyde: it is used to produce other chemicals. For example, it is used to produce Norbornan-2-yl-methanol. The reaction occurs with reagent Diiron Nonacarbonyl and other condition of heating for 48 hours. The yield is 68 %.
![Bicyclo[2.2.1]heptane-2-carboxaldehyde is used to produce Norbornan-2-yl-methanol](/UserFilesUpload/Use of Bicyclo[2_2_1]heptane-2-carboxaldehyde.png){kind=small}
When you are using this chemical, please be cautious about it as the following:
As a chemical, it irritates to eyes and respiratory system. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: O=CC1CC2CCC1C2
(2) InChI: InChI=1/C8H12O/c9-5-8-4-6-1-2-7(8)3-6/h5-8H,1-4H2
(3) InChIKey: UAQYREPFSVCDHT-UHFFFAOYAQ