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| | TRANS-1,2-CYCLOHEXANEDIOL Basic information |
| Product Name: | TRANS-1,2-CYCLOHEXANEDIOL | | Synonyms: | #ntrans-1,2-Cyclohexanediol;1,2-Cyclohexanediol, (1R,2R)-rel-;trans-hexahydrobrenzkatechin;rel-(1S*,2S*)-1,2-Cyclohexanediol;rel-(1S*,2S*)-Cyclohexane-1,2-diol;rel-1β*,2α*-Dihydroxycyclohexane;trans-1,2-Cyclohexanediol,98%;1,2-Cyclohexanediol-trans | | CAS: | 1460-57-7 | | MF: | C6H12O2 | | MW: | 116.16 | | EINECS: | 215-956-6 | | Product Categories: | Building Blocks;Chemical Synthesis;Organic Building Blocks;Oxygen Compounds;Benzhydrols, Benzyl & Special Alcohols;Aromatic alcohols and diols;Miscellaneous Reagents;Alcohols;Monomers;Polymer Science;Organic Building Blocks;Oxygen Compounds;Polyols | | Mol File: | 1460-57-7.mol |  |
| | TRANS-1,2-CYCLOHEXANEDIOL Chemical Properties |
| Melting point | 101-104 °C(lit.) | | Boiling point | 117 °C (12.7517 mmHg) | | density | 0.9958 (rough estimate) | | vapor pressure | 4 hPa (110 °C) | | refractive index | 1.4270 (estimate) | | Fp | 134 °C | | storage temp. | Store below +30°C. | | solubility | Soluble in chloroform and methanol. | | form | Crystals or Crystalline Powder | | pka | 14.49±0.40(Predicted) | | color | Off-white | | BRN | 3193810 | | InChI | 1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6-/m1/s1 | | InChIKey | PFURGBBHAOXLIO-PHDIDXHHSA-N | | SMILES | O[C@@H]1CCCC[C@H]1O | | CAS DataBase Reference | 1460-57-7(CAS DataBase Reference) | | NIST Chemistry Reference | 1,2-Cyclohexanediol, trans-(1460-57-7) | | EPA Substance Registry System | trans-1,2-Cyclohexanediol (1460-57-7) |
| Hazard Codes | F | | Safety Statements | 23-24/25 | | WGK Germany | 3 | | Autoignition Temperature | 360 °C | | HS Code | 2906 19 00 | | Storage Class | 11 - Combustible Solids |
| | TRANS-1,2-CYCLOHEXANEDIOL Usage And Synthesis |
| Chemical Properties | OFF-WHITE CRYSTALS OR CRYSTALLINE POWDER | | Uses | trans-1,2-Cyclohexanediol is used as an organic chemical synthesis intermediate. | | Definition | ChEBI: A cyclohexane-1,2-diol with trans-configuration. It is a metabolite of cyclohexene oxide and other such compounds. | | Purification Methods | Crystallise the diol from Me2CO and dry it at 50o for several days. It can also be recrystallised from CCl4 or EtOAc and it can be distilled. The 2,4-dinitrobenzoyl derivative has m 179o. [Winstein & Buckles J Am Chem Soc 64 2780 1942.] [Beilstein 6 IV 5194.] |
| | TRANS-1,2-CYCLOHEXANEDIOL Preparation Products And Raw materials |
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