9-Chloro-1,2,3,4-tetrahydroacridine

Base Information

• Chemical Name: 9-Chloro-1,2,3,4-tetrahydroacridine
• CAS No.: 5396-30-5
• Molecular Formula: C13H12 Cl N
• Molecular Weight: 217.698
• Hs Code.: 2933990090
• European Community (EC) Number: 654-150-2
• NSC Number: 1235
• UNII: 59YJK4BWG6
• DSSTox Substance ID: DTXSID40202248
• Nikkaji Number: J66.941E
• Wikidata: Q83075520
• ChEMBL ID: CHEMBL3221003
• Mol file: 5396-30-5.mol

Synonyms:9-Chloro-1,2,3,4-tetrahydroacridine;5396-30-5;1,2,3,4-Tetrahydro-9-chloroacridine;ACRIDINE, 1,2,3,4-TETRAHYDRO-9-CHLORO-;NSC 1235;9-chloro-5,6,7,8-tetrahydroacridine;BRN 0147607;59YJK4BWG6;Acridine, 9-chloro-1,2,3,4-tetrahydro-;NSC-1235;5-20-07-00600 (Beilstein Handbook Reference);9-Chloro-1,2,3,4-tetrahydro-acridine;NSC1235;9-chlorotetrahydroacridine;UNII-59YJK4BWG6;SCHEMBL1337681;C13-H12-Cl-N;CHEMBL3221003;DTXSID40202248;KUC110914N;AMY31795;MFCD00065216;STK501220;9chloro-1,2,3,4-tetrahydroacridine;AKOS000265450;KSC-280-035;9-chloranyl-1,2,3,4-tetrahydroacridine;AC-17534;LS-02224;9-CHLORO-1,3,4-TETRAHYDROACRIDINE;BB 0301107;CS-0069003;FT-0635663;A829866

Chemical Property of 9-Chloro-1,2,3,4-tetrahydroacridine

Chemical Property:

• Vapor Pressure: 5.43E-05mmHg at 25°C
• Melting Point: 94.5-95.5 °C
• Boiling Point: 358°Cat760mmHg
• PKA: 4.56±0.20(Predicted)
• Flash Point: 201.6°C
• PSA: 12.89000
• Density: 1.24g/cm³
• LogP: 3.76700
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 217.0658271
• Heavy Atom Count: 15
• Complexity: 231

Purity/Quality:

95% ^*data from raw suppliers

9-Chloro-1,2,3,4-tetrahydroacridine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC2=NC3=CC=CC=C3C(=C2C1)Cl

Technology Process of 9-Chloro-1,2,3,4-tetrahydroacridine

There total 33 articles about 9-Chloro-1,2,3,4-tetrahydroacridine 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: 100.0%

1,2,3,4,9,10-hexahydroacridin-9-one (13161-85-8) → 9-chloro-1,2,3,4-tetrahydroacridine (5396-30-5)

Guidance literature:

With trichlorophosphate; for 3h; Heating;

DOI:10.1002/ardp.200400919

Reference yield: 100.0%

spiro<2H-3,1-benzoxazine-2,1'-cyclohexan>-4(1H)-one (96447-10-8) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → 9-chloro-1,2,3,4-tetrahydroacridine (5396-30-5)

Guidance literature:

N,N-dimethyl-formamide; With trichlorophosphate; Cooling with ice;

spiro<2H-3,1-benzoxazine-2,1'-cyclohexan>-4(1H)-one; for 1h;

DOI:10.1016/j.tet.2015.06.069

Reference yield: 100.0%

1,2,3,4,9,10-hexahydroacridin-9-one (13161-85-8) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → 9-chloro-1,2,3,4-tetrahydroacridine (5396-30-5)

Guidance literature:

N,N-dimethyl-formamide; With trichlorophosphate; Cooling with ice;

1,2,3,4,9,10-hexahydroacridin-9-one; for 0.5h;

DOI:10.1016/j.tet.2015.06.069

upstream raw materials:

4-hydroxy-2,3-(tetramethylene)quinoline

1,2,3,4,9,10-hexahydroacridin-9-one

spiro<2H-3,1-benzoxazine-2,1'-cyclohexan>-4(1H)-one

phosphorus pentachloride

Downstream raw materials:

4-Morpholino-2,3-tetramethylenequinoline

9-phenoxy-1,2,3,4-tetrahydro-acridine

tacrin

4-(3-Methyl-1-piperidyl)-2,3-tetramethylenequinoline