L-carnitine

Compound Structure

CAS Number: 541-15-1

Molecular Mass: 161.2 g/mol

Formula: C7H15NO3

Smiles: C[N+](C)(C)C[C@H](O)CC(=O)[O-]

Synonymes:

Bioactivity: -

Solubility in Different Solvents

Solvent Temperature [K] Crystal form Solubility [mg/mL] Reference
Acetone 278.15 - 0.159 [410]
Acetone 283.15 - 0.18 [410]
Acetone 288.15 - 0.201 [410]
Acetone 293.15 - 0.2325 [410]
Acetone 298.15 - 0.2549 [410]
Acetone 303.15 - 0.2833 [410]
Acetone 308.15 - 0.307 [410]
Acetone 313.15 - 0.3345 [410]
Acetone 318.15 - 0.3699 [410]
Acetone 323.15 - 0.4092 [410]
Acetone 328.15 - 0.458 [410]
Ethanol 278.15 - 114.5 [410]
Ethanol 283.15 - 118.8 [410]
Ethanol 288.15 - 125.0 [410]
Ethanol 293.15 - 130.9 [410]
Ethanol 298.15 - 139.6 [410]
Ethanol 303.15 - 149.1 [410]
Ethanol 308.15 - 156.8 [410]
Ethanol 313.15 - 165.3 [410]
Ethanol 318.15 - 173.7 [410]
Ethanol 323.15 - 185.1 [410]
Ethanol 328.15 - 199.0 [410]
Ethanol 333.15 - 213.2 [410]
Ethanol 338.15 - 228.6 [410]
Ethanol 343.15 - 244.1 [410]
Ethanol 348.15 - 262.7 [410]
Isopropanol 278.15 - 3.139 [410]
Isopropanol 283.15 - 3.863 [410]
Isopropanol 288.15 - 4.742 [410]
Isopropanol 293.15 - 5.722 [410]
Isopropanol 298.15 - 7.156 [410]
Isopropanol 303.15 - 8.733 [410]
Isopropanol 308.15 - 10.97 [410]
Isopropanol 313.15 - 13.05 [410]
Isopropanol 318.15 - 16.06 [410]
Isopropanol 323.15 - 20.22 [410]
Isopropanol 328.15 - 24.26 [410]
Isopropanol 333.15 - 29.48 [410]
Methanol 278.15 - 431.4 [410]
Methanol 283.15 - 438.6 [410]
Methanol 288.15 - 463.1 [410]
Methanol 293.15 - 495.0 [410]
Methanol 298.15 - 534.2 [410]
Methanol 303.15 - 572.7 [410]
Methanol 308.15 - 613.0 [410]
Methanol 313.15 - 654.4 [410]
Methanol 318.15 - 703.5 [410]
Methanol 323.15 - 759.0 [410]
Methanol 328.15 - 822.9 [410]
Methanol 333.15 - 885.0 [410]

Molecule 3D descriptors

Descriptor Value
PMI1 229.0947
PMI2 920.2814
PMI3 987.1210
NPR1 0.2321
NPR2 0.9323
RadiusOfGyration 2.5743
InertialShapeFactor 0.0041
Eccentricity 0.9727
Asphericity 0.4630
SpherocityIndex 0.4582
PBF 0.8416