1-HYDROXYADAMANTANE-3-CARBOXYLIC ACID
3-hydroxyadamantane-1-carboxylic acid
CAS: 42711-75-1
Molecular Formula: C11H16O3
1-HYDROXYADAMANTANE-3-CARBOXYLIC ACID - Names and Identifiers
| Name | 3-hydroxyadamantane-1-carboxylic acid |
| Synonyms | AKOS BC-0508 TIMTEC-BB SBB010113 3-Carboxyadamantan-1-ol 3-HYDROXYADAMANTANCARBOXYLIC ACID 3-HYDROXYADAMANTANECARBOXYLIC ACID 3-Hydroxy-1-adamantanecarboxylic acid 3-Hydroxy--1-Amantane Carboxylic Acid 3-hydroxyadamantane-1-carboxylic acid 1-HYDROXYADAMANTANE-3-CARBOXYLIC ACID 3-Hydroxy-1-Adamantanecarboxylic Acid 3-HYDROXYADAMANTANE-1-CARBOXYLIC ACID 3-Hydroxy-1-Adamantane Carboxylic Acid 3-hydroxytricyclo[3.3.1.1~3,7~]decane-1-carboxylic acid (5R,7R)-3-hydroxytricyclo[3.3.1.1~3,7~]decane-1-carboxylate |
| CAS | 42711-75-1 |
| InChI | InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13) |
1-HYDROXYADAMANTANE-3-CARBOXYLIC ACID - Physico-chemical Properties
| Molecular Formula | C11H16O3 |
| Molar Mass | 196.24 |
| Density | 1.419±0.06 g/cm3(Predicted) |
| Melting Point | 203 °C |
| Boling Point | 357.2±25.0 °C(Predicted) |
| Flash Point | 184°C |
| Solubility | DMSO (Slightly), Methanol (Slightly) |
| Vapor Presure | 1.55E-06mmHg at 25°C |
| Appearance | Solid |
| Color | Off-White |
| pKa | 4.60±0.40(Predicted) |
| Storage Condition | Sealed in dry,Room Temperature |
| Refractive Index | 1.638 |
| MDL | MFCD00193929 |
1-HYDROXYADAMANTANE-3-CARBOXYLIC ACID - Risk and Safety
| Risk Codes | R36/37/38 - Irritating to eyes, respiratory system and skin. R22 - Harmful if swallowed |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection. S37/39 - Wear suitable gloves and eye/face protection S24/25 - Avoid contact with skin and eyes. |
| WGK Germany | 3 |
| HS Code | 29181990 |
| Hazard Class | IRRITANT |
1-HYDROXYADAMANTANE-3-CARBOXYLIC ACID - Reference Information
| Uses | 3-hydroxyadamantane can be used to synthesize 11β-HSD-1 effective pyridinamide/sulfonamide inhibitors, can be used to treat ulcers or cortisol-related hormone therapy. |
| Preparation | The two functional groups of 3-hydroxy-1-adamantanoic acid are different, and it is difficult to prepare from adamantane in one step. The synthesis of 1-hydroxyadamantane is mainly prepared by bromination and hydrolysis. In the bromination process, the toxic and corrosive bromine is used, and the products are mostly mixtures. 1-adamantane formic acid can be synthesized by the Koch-Haff reaction between 1-bromoadantane and formic acid, and can also be directly prepared in carbon tetrachloride solution under the action of concentrated sulfuric acid, tert-butanol and formic acid. Therefore, it is more appropriate to select 1-adamantane formic acid as the raw material. 3-hydroxy-1-adamantane formic acid was synthesized from 1-adamantane formic acid by bromination and hydrolysis. |
Last Update：2024-04-09 21:54:55
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