3,5-Dimethyl-3'-Isopropyl-L-Thyronine
[CAS# 26384-44-1]

Identification

• Name: 3,5-Dimethyl-3'-Isopropyl-L-Thyronine
• Synonyms: (2S)-2-Amino-3-[4-(4-Hydroxy-3-Isopropyl-Phenoxy)-3,5-Dimethyl-Phenyl]Propanoic Acid; (2S)-2-Amino-3-[4-(4-Hydroxy-3-Isopropylphenoxy)-3,5-Dimethylphenyl]Propanoic Acid; (2S)-2-Amino-3-[4-(4-Hydroxy-3-Isopropyl-Phenoxy)-3,5-Dimethyl-Phenyl]Propionic Acid
• Molecular Formula: C₂₀H₂₅NO₄
• Molecular Weight: 343.42
• CAS Registry Number: 26384-44-1
• SMILES: [C@H](CC1=CC(=C(C(=C1)C)OC2=CC(=C(C=C2)O)C(C)C)C)(C(O)=O)N
• InChI: 1S/C20H25NO4/c1-11(2)16-10-15(5-6-18(16)22)25-19-12(3)7-14(8-13(19)4)9-17(21)20(23)24/h5-8,10-11,17,22H,9,21H2,1-4H3,(H,23,24)/t17-/m0/s1
• InChIKey: QHHWMOKQVCJRPS-KRWDZBQOSA-N

Properties

• Density: 1.188g/cm³ (Cal.)
• Boiling point: 493.08°C at 760 mmHg (Cal.)
• Flash point: 252.006°C (Cal.)