2-Adamantanol
Synonym(s):2-Hydroxyadamantane
- CAS NO.：700-57-2
- Empirical Formula: C10H16O
- Molecular Weight: 152.23
- MDL number: MFCD00074744
- EINECS: 211-846-7
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-11-03 11:32:31
What is 2-Adamantanol?
Chemical properties
white to off-white crystalline powder
The Uses of 2-Adamantanol
The low-temperature X-ray structure of 2-adamantanol ester has been studied.
2-Adamantanol was used to synthesize ester imides.
General Description
The low-temperature X-ray structure of 2-adamantanol ester has been studied.
Purification Methods
It can be purified by chromatography as for the 1-isomer. It crystallises from cyclohexane and has characteristic IR, max 3600, 1053, 1029 and 992cm-1 [Schleyer & Nicholas J Am Chem Soc 83 182 1961].
Properties of 2-Adamantanol
| Melting point: | 258-262 °C (lit.) |
| Boiling point: | 214.73°C (rough estimate) |
| Density | 0.8544 (rough estimate) |
| refractive index | 1.4880 (estimate) |
| storage temp. | Store below +30°C. |
| solubility | soluble in Methanol |
| form | Crystalline Powder |
| pka | 14.93±0.20(Predicted) |
| color | White to off-white |
| Water Solubility | INSOLUBLE |
| BRN | 1903957 |
| InChI | InChI=1S/C10H16O/c11-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-11H,1-5H2 |
| CAS DataBase Reference | 700-57-2(CAS DataBase Reference) |
| NIST Chemistry Reference | Adamantan-2-ol(700-57-2) |
Safety information for 2-Adamantanol
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral |
| Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 2-Adamantanol
| InChIKey | FOWDOWQYRZXQDP-UHFFFAOYSA-N |
| SMILES | C12CC3CC(CC(C3)C1O)C2 |
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