D-Valine, N-acetyl- (17916-88-0)

The D-Valine, N-acetyl-, with CAS registry number 17916-88-0, belongs to the following product categories: (1)Amino Acid Derivatives; (2)Amino Acids; (3)Ac-Amino Acids; (4)Amino Acids (N-Protected); (5)Biochemistry. It has the systematic name of N-acetyl-D-valine. And this chemical should be stored at the temperature of −20°C.

Physical properties of D-Valine, N-acetyl-: (1)ACD/LogP: -0.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.3; (4)ACD/LogD (pH 7.4): -3.75; (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: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 46.61 Å²; (13)Index of Refraction: 1.456; (14)Molar Refractivity: 39.58 cm³; (15)Molar Volume: 145.3 cm³; (16)Polarizability: 15.69×10^-24cm³; (17)Surface Tension: 37.6 dyne/cm; (18)Enthalpy of Vaporization: 66.79 kJ/mol; (19)Vapour Pressure: 3.14E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The D-Valine, N-acetyl- irritates to eyes, respiratory system and skin. And this chemical may cause sensitization by skin contact. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N[C@@H](C(=O)O)C(C)C)C
(2)InChI: InChI=1/C7H13NO3/c1-4(2)6(7(10)11)8-5(3)9/h4,6H,1-3H3,(H,8,9)(H,10,11)/t6-/m1/s1
(3)InChIKey: IHYJTAOFMMMOPX-ZCFIWIBFBK
(4)Std. InChI: InChI=1S/C7H13NO3/c1-4(2)6(7(10)11)8-5(3)9/h4,6H,1-3H3,(H,8,9)(H,10,11)/t6-/m1/s1
(5)Std. InChIKey: IHYJTAOFMMMOPX-ZCFIWIBFSA-N