3-Hydroxyphencyclidine

Base Information

• Chemical Name: 3-Hydroxyphencyclidine
• CAS No.: 79787-43-2
• Molecular Formula: C17H25 N O
• Molecular Weight: 259.392
• UNII: V886QLHNA6
• DSSTox Substance ID: DTXSID20229918
• Nikkaji Number: J390.364H
• Wikipedia: 3-HO-PCP
• Wikidata: Q20707014
• ChEMBL ID: CHEMBL123708
• Mol file: 79787-43-2.mol

Synonyms:1-(1-(3-hydroxyphenyl)-cyclohexyl)piperidine;3-hydroxyphencyclidine;3-hydroxyphencyclidine hydrochloride;PCP-3-OH

 This product is a nationally controlled contraband, and the Lookchem platform doesn't provide relevant sales information.

Chemical Property of 3-Hydroxyphencyclidine

Chemical Property:

• Vapor Pressure: 9.17E-07mmHg at 25°C
• Boiling Point: 393.7°C at 760 mmHg
• Flash Point: 185.6°C
• PSA: 23.47000
• Density: 1.086g/cm³
• LogP: 3.97540
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 259.193614421
• Heavy Atom Count: 19
• Complexity: 279

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)(C2=CC(=CC=C2)O)N3CCCCC3
• Description: 3-Hydroxyphencyclidine (3-HO-PCP) is a dissociative hallucinogen of the arylcyclohexylamine class related to phencyclidine (PCP) that has been sold online as a designer drug. On October 18, 2012 the Advisory Council on the Misuse of Drugs in the United Kingdom released a report about methoxetamine, saying that the "harms of methoxetamine are commensurate with Class B of the Misuse of Drugs Act (1971)", despite the fact that the act does not classify drugs based on harm. The report went on to suggest that all analogues of MXE should also become class B drugs and suggested a catch-all clause covering both existing and unresearched arylcyclohexamines, including 3-HO-PCP.

Technology Process of 3-Hydroxyphencyclidine

There total 10 articles about 3-Hydroxyphencyclidine 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: 93.0%

N-[1-(3-methoxyphenyl)cyclohexyl]piperidine (91164-58-8) → N-[1-(3-hydroxyphenyl)cyclohexyl]piperidine (79787-43-2)

Guidance literature:

With hydrogen bromide; acetic acid; at 120 ℃; for 3h;

DOI:10.1002/(SICI)1099-1344(1998090)41:9<843::AID-JLCR136>3.0.CO;2-H

Reference yield:

Phencyclidine (77-10-1) + 1-(1-d5-phenylcyclohexyl)piperidine (60124-86-9) → N-[1-(3-hydroxyphenyl)cyclohexyl]piperidine (79787-43-2) + C17H21(2)H4NO

Guidance literature:

With glucose-6-phosphate dehydrogenase; α-D-glucose 6-phosphate; oxygen; NADPH; In water; at 37 ℃; for 0.333333h; Product distribution; competition reaction: sodium phosphate buffer, pH = 7.4;

DOI:10.1248/cpb.37.1788

Reference yield:

Phencyclidine (77-10-1) → 4-(1-Piperidin-1-yl-cyclohexyl)-phenol (66568-88-5) + 4-Phenyl-4-piperidinocyclohexanol (60756-83-4) + N-[1-(3-hydroxyphenyl)cyclohexyl]piperidine (79787-43-2) + 2-(1-Piperidin-1-yl-cyclohexyl)-phenol (83400-97-9) + 5-pentanoic acid (77160-83-9) + 3-hydroxy-1-(1-phenylcyclohexyl)piperidine (94852-59-2)

Guidance literature:

With perchloric acid; ferrous perchlorate; dihydrogen peroxide; In water; acetonitrile; at 37 ℃; for 1h; Product distribution; var. reag.: O₂ and ascorbic acid; Fe(III)TPPCl and iodosylxylene or cumene hydroperoxide;Fe(III)TPPCl,O₂ and Zn, AcOH; liver microsomes and NADPH, O₂;

DOI:10.1248/cpb.37.1788

upstream raw materials:

Phencyclidine

1-(1-d₅-phenylcyclohexyl)piperidine

N-[1-(3-methoxyphenyl)cyclohexyl]piperidine

1,5-dibromo-pentane

Downstream raw materials:

C₂₁H₃₃NO

C₁₉H₂₆F₃NO

3-methoxyphencyclidine

Refernces

• 1、 Haradahira, Terushi,Sasaki, Sigeki,Maeda, Minoru,Kobayashi, Kaoru,Inoue, Osamu,Tomita, Urara,Nishikawa, Toru,Suzuki, Kazutoshi. "Synthesis and brain distribution of carbon-11 labeled analogs of antagonists for the NMDA receptor coupled PCP-binding site". . p. 843 - 858. Retrieved 2007/10/03.