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| CAS No.: | 65355-00-2 |
|---|---|
| Name: | (R)-(+)-5,5',6,6',7,7',8,8'-OCTAHYDRO-1,1'-BI-2-NAPHTHOL |
| Article Data: | 1 |
| Molecular Structure: | |
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| Formula: | C20H22O2 |
| Molecular Weight: | 294.393 |
| Synonyms: | [1,1'-Binaphthalene]-2,2'-diol,5,5',6,6',7,7',8,8'-octahydro-, (S)-;(S)-2,2'-Dihydroxy-5,5',6,6',7,7',8,8'-octahydro-1,1'-binaphthyl;(S)-5,5',6,6',7,7',8,8'-Octahydro-1,1'-bi-2-naphthol;Octahydro-(S)-BINOL; |
| Density: | 1.2 g/cm3 |
| Melting Point: | 165-169 °C(lit.) |
| Boiling Point: | 516.7 °C at 760 mmHg |
| Flash Point: | 244 °C |
| Appearance: | white powder |
| Hazard Symbols: |
 Xi, N
|
| Risk Codes: | 36-50/53-36/37/38 |
| Safety: | 26-60-61 |
| PSA: | 40.46000 |
| LogP: | 4.52240 |
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Specification
The (S)-(-)-5,5',6,6',7,7',8,8'-Octahydro-1,1'-bi-2-naphthol, with the CAS registry number 65355-00-2, is also known as [1,1'-Binaphthalene]-2,2'-diol, 5,5',6,6',7,7',8,8'-octahydro-. It belongs to the product categories of Binols; Chiral Catalysts, Ligands, and Reagents; Privileged Ligands and Complexes. This chemical's molecular formula is C20H22O2 and molecular weight is 294.39. Its systematic name is called 5,5',6,6',7,7',8,8'-octahydro-1,1'-binaphthalene-2,2'-diol.
Physical properties of (S)-(-)-5,5',6,6',7,7',8,8'-Octahydro-1,1'-bi-2-naphthol: (1)ACD/LogP: 5.27; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 18.46 Å2; (7)Index of Refraction: 1.638; (8)Molar Refractivity: 88.18 cm3; (9)Molar Volume: 245.2 cm3; (10)Surface Tension: 53.4 dyne/cm; (11)Density: 1.2 g/cm3; (12)Melting Point: 165-169 °C(lit.); (13)Flash Point: 244 °C; (14)Enthalpy of Vaporization: 81.87 kJ/mol; (15)Boiling Point: 516.7 °C at 760 mmHg; (16)Vapour Pressure: 2.68E-11 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 and may present an immediate or delayed danger to one or more components of the environment. In addition, it is irritating to eyes. It is very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. What's more, 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. This material and its container must be disposed of as hazardous waste. Finally, you are avoided releasing it to the environment.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc4c(c1c2c(O)ccc3c2CCCC3)CCCC4
(2)InChI: InChI=1/C20H22O2/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22/h9-12,21-22H,1-8H2
(3)InChIKey: UTXIFKBYNJRJPH-UHFFFAOYAF