(S)-(+)-2-NONANOL

The 2-Nonanol, (2S)- is an organic compound with the formula C₉H₂₀O. The systematic name of this chemical is (2S)-nonan-2-ol. With the CAS registry number 70419-06-6, it is also named as (S)-(+)-2-Nonanol. The product's categories are Alcohols; Chiral Building Blocks; Organic Building Blocks. Besides, it should be stored in a closed cool and dry place.

Physical properties about 2-Nonanol, (2S)- are: (1)ACD/LogP: 3.23; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 206; (5)ACD/BCF (pH 7.4): 206; (6)ACD/KOC (pH 5.5): 1579; (7)ACD/KOC (pH 7.4): 1579; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 7; (11)Polar Surface Area: 20.23 Å²; (12)Index of Refraction: 1.43; (13)Molar Refractivity: 45.238 cm³; (14)Molar Volume: 174.979 cm³; (15)Polarizability: 17.934×10^-24cm³; (16)Surface Tension: 28.51 dyne/cm; (17)Density: 0.824 g/cm³; (18)Flash Point: 82.222 °C; (19)Enthalpy of Vaporization: 50.236 kJ/mol; (20)Boiling Point: 195.522 °C at 760 mmHg; (21)Vapour Pressure: 0.108 mmHg at 25°C.

Preparation of 2-Nonanol, (2S)-: this chemical can be prepared by nonan-2-one. This reaction will need reagents dried cells of Geotrichum candidum IFO 4597, NADP+, cyclopentanol. The reaction time is 20 hours with reaction temperature of 30 °C. The yield is about 88%.

Uses of 2-Nonanol, (2S)-: it can be used to produce 4-nitro-benzoic acid 1-methyl-octyl ester. It will need reagents DPPE, DEAD and solvent tetrahydrofuran. The yield is about 98%.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCCCCC[C@H](C)O
(2)InChI: InChI=1/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3/t9-/m0/s1
(3)InChIKey: NGDNVOAEIVQRFH-VIFPVBQEBT
(4)Std. InChI: InChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3/t9-/m0/s1
(5)Std. InChIKey: NGDNVOAEIVQRFH-VIFPVBQESA-N