L-Leucine, N-methyl- (3060-46-6)

The N-Methyl-L-leucine, with CAS registry number 3060-46-6, belongs to the following product category: Amino Acid Derivatives. It has the systematic name of N-methyl-L-leucine. This chemical should be stored in cool, dry place. And the chemical formula of this chemical is C₇H₁₅NO₂.

Physical properties of N-Methyl-L-leucine: (1)ACD/LogP: 0.97; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.53; (4)ACD/LogD (pH 7.4): -1.54; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.446; (14)Molar Refractivity: 39.55 cm³; (15)Molar Volume: 148.2 cm³; (16)Polarizability: 15.68×10^-24cm³; (17)Surface Tension: 32.9 dyne/cm; (18)Enthalpy of Vaporization: 50.97 kJ/mol; (19)Vapour Pressure: 0.0303 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC)CC(C)C
(2)InChI: InChI=1/C7H15NO2/c1-5(2)4-6(8-3)7(9)10/h5-6,8H,4H2,1-3H3,(H,9,10)/t6-/m0/s1
(3)InChIKey: XJODGRWDFZVTKW-LURJTMIEBL
(4)Std. InChI: InChI=1S/C7H15NO2/c1-5(2)4-6(8-3)7(9)10/h5-6,8H,4H2,1-3H3,(H,9,10)/t6-/m0/s1
(5)Std. InChIKey: XJODGRWDFZVTKW-LURJTMIESA-N