Optimax
[CAS# 62602-94-2]

Identification

• Name: Optimax
• Synonyms: (2S)-2-Amino-3-(1H-Indol-3-Yl)Propanoic Acid; 4,5-Bis(Hydroxymethyl)-2-Methyl-Pyridin-3-Ol; (2R)-2-[(1S)-1,2-Dihydroxyethyl]-4,5-Dihydroxy-Furan-3-One; Hydrochloride; (2S)-2-Amino-3-(1H-Indol-3-Yl)Propanoic Acid; 4,5-Bis(Hydroxymethyl)-2-Methyl-3-Pyridinol
• Molecular Formula: C₂₅H₃₂ClN₃O₁₁
• Molecular Weight: 585.99
• CAS Registry Number: 62602-94-2
• SMILES: [C@H](N)(CC1=C[NH]C2=CC=CC=C12)C(O)=O.[C@@H]3(OC(=C(O)C3=O)O)[C@@H](O)CO.[H+].[Cl-].C(O)C4=C(O)C(=NC=C4CO)C
• InChI: 1S/C11H12N2O2.C8H11NO3.C6H8O6.ClH/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10;1-5-8(12)7(4-11)6(3-10)2-9-5;7-1-2(8)5-3(9)4(10)6(11)12-5;/h1-4,6,9,13H,5,12H2,(H,14,15);2,10-12H,3-4H2,1H3;2,5,7-8,10-11H,1H2;1H/t9-;;2-,5+;/m0.0./s1
• InChIKey: RDXUBTLYLMAJOL-WDFFVJGCSA-N

Properties

• Boiling point: 447.9°C at 760 mmHg (Cal.)
• Flash point: 224.7°C (Cal.)