2-Oxo-3-hydroxy-lysergide

Base Information

• Chemical Name: 2-Oxo-3-hydroxy-lysergide
• CAS No.: 111295-09-1
• Molecular Formula: C20H25N3O3
• Molecular Weight: 355.4308
• UNII: KU55DR6345
• DSSTox Substance ID: DTXSID00436244
• Nikkaji Number: J1.084.747H
• Wikidata: Q27282436
• Mol file: 111295-09-1.mol

Synonyms:2-oxo-3-hydroxy-LSD;2-oxo-3-hydroxy-lysergide;2-oxo-3-hydroxylysergic acid diethylamide;2-oxo-3-OH-LSD

Chemical Property of 2-Oxo-3-hydroxy-lysergide

Chemical Property:

• Flash Point: 2℃
• PSA: 76.37000
• LogP: 1.43500
• Storage Temp.: ?20°C
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 355.18959167
• Heavy Atom Count: 26
• Complexity: 644

Purity/Quality:

98%,99%, ^*data from raw suppliers

2,3-Dihydro-3-hydroxy-2-oxoLysergide(100μg/mLinAcetonitrile) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F,Xn
• Statements: 11-20/21/22-36
• Safety Statements: 16-36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)C(=O)C1CN(C2CC3(C4=C(C2=C1)C=CC=C4NC3=O)O)C
• Isomeric SMILES: CCN(CC)C(=O)[C@H]1CN([C@@H]2CC3(C4=C(C2=C1)C=CC=C4NC3=O)O)C
• Uses: 2,3-Dihydro-3-hydroxy-2-oxo Lysergide is a major metabolite of Lysergide (L488010). Controlled Substance.

Technology Process of 2-Oxo-3-hydroxy-lysergide

There total 3 articles about 2-Oxo-3-hydroxy-lysergide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

lysergide (50-37-3) → 2-oxo-3-hydroxylysergic acid diethylamide (111295-09-1)

Guidance literature:

With water; hydrogen bromide; dimethyl sulfoxide; at 20 ℃; for 1.66667h;

Reference yield:

lysergide (50-37-3) → 3-hydroxy-6-methyl-2-oxo-9,10-didehydro-(3β)-2,3-dihydro-ergoline-8β-carboxylic acid diethylamide (111295-09-1)

Guidance literature:

With water; tartaric acid; calcium chloride;

DOI:10.1002/hlca.19590420321

Reference yield:

→ 2-oxo-3-hydroxylysergic acid diethylamide (111295-09-1)

Guidance literature:

upstream raw materials:

lysergide

Refernces

• 1、 -. "Immunoassay for LSD and 2-oxo-3-hydroxy-LSD". . . Retrieved 2008/06/13.