1-Butanol, 2-methyl-,acetate, (2S)- (6493-92-1)

The (S)-2-Methylbutyl acetate is an organic compound with the formula C₇H₁₄O₂. The systematic name of this chemical is 2-methylbutyl acetate. With the CAS registry number 6493-92-1, it is also named as 1-butanol, 2-methyl-, acetate, (2S)-.

Physical properties about (S)-2-Methylbutyl acetate are: (1)ACD/LogP: 2.12; (2)ACD/LogD (pH 5.5): 2.12; (3)ACD/LogD (pH 7.4): 2.12; (4)#H bond acceptors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 26.3 Å²; (7)Index of Refraction: 1.404; (8)Molar Refractivity: 36.21 cm³; (9)Molar Volume: 147.9 cm³; (10)Polarizability: 14.35×10^-24cm³; (11)Surface Tension: 25.5 dyne/cm; (12)Density: 0.879 g/cm³; (13)Flash Point: 35 °C; (14)Enthalpy of Vaporization: 37.25 kJ/mol; (15)Boiling Point: 135.1 °C at 760 mmHg; (16)Vapour Pressure: 7.85 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(CC)COC(C)=O
(2)InChI: InChI=1/C7H14O2/c1-4-6(2)5-9-7(3)8/h6H,4-5H2,1-3H3/t6-/m0/s1
(3)InChIKey: XHIUFYZDQBSEMF-LURJTMIEBR
(4)Std. InChI: InChI=1S/C7H14O2/c1-4-6(2)5-9-7(3)8/h6H,4-5H2,1-3H3
(5)Std. InChIKey: XHIUFYZDQBSEMF-UHFFFAOYSA-N