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| CAS No.: | 5921-73-3 |
|---|---|
| Name: | 2-Nonyn-1-ol |
| Article Data: | 49 |
| Molecular Structure: | |
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| Formula: | C9H16O |
| Molecular Weight: | 140.225 |
| Synonyms: | 1-Hydroxy-2-nonyne;Non-2-yn-1-ol; |
| EINECS: | 227-646-8 |
| Density: | 0.887 g/cm3 |
| Melting Point: | -16°C(lit.) |
| Boiling Point: | 160.9 °C at 760 mmHg |
| Flash Point: | 54.9 °C |
| Solubility: | Not miscible in water. |
| Safety: | 24/25 |
| PSA: | 20.23000 |
| LogP: | 1.95250 |
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- Total:34 Page 1 of 1 1
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Specification
The CAS register number of 2-Nonyn-1-ol is 5921-73-3. It also can be called as 1-Hydroxy-2-nonyne and the IUPAC name about this chemical is non-2-yn-1-ol. The molecular formula about this chemical is C9H16O and the molecular weight is 140.22. When you are using it, please avoid contact with skin and eyes. This chemical is stable under normal temperature and pressure.
Physical properties about 2-Nonyn-1-ol are: (1)ACD/LogP: 2.78; (2)ACD/LogD (pH 5.5): 2.78; (3)ACD/LogD (pH 7.4): 2.78; (4)ACD/BCF (pH 5.5): 76.63; (5)ACD/BCF (pH 7.4): 76.63; (6)ACD/KOC (pH 5.5): 777.06; (7)ACD/KOC (pH 7.4): 777.06; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 9.23Å2; (12)Index of Refraction: 1.46; (13)Molar Refractivity: 43.28 cm3; (14)Molar Volume: 157.9 cm3; (15)Polarizability: 17.15x10-24cm3; (16)Surface Tension: 35.3 dyne/cm; (17)Enthalpy of Vaporization: 46.29 kJ/mol; (18)Boiling Point: 160.9 °C at 760 mmHg; (19)Vapour Pressure: 0.81 mmHg at 25°C.
Preparation: this chemical can be prepared by formaldehyde and oct-1-yne. This reaction will need reagent EtMgI.
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Uses of 2-Nonyn-1-ol: it can be used to produce 1-bromo-non-2-yne. This reaction will need reagent PBr3, Py.
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You can still convert the following datas into molecular structure:
(1)SMILES: C(#CCO)CCCCCC
(2)InChI: InChI=1/C9H16O/c1-2-3-4-5-6-7-8-9-10/h10H,2-6,9H2,1H3
(3)InChIKey: XERDOEKKHDALKJ-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h10H,2-6,9H2,1H3
(5)Std. InChIKey: XERDOEKKHDALKJ-UHFFFAOYSA-N