10,11-Dihydro-5-(3-dimethylamino-2-methylpropyl)-5H-dibenzo(a,d)cyclohepten-5-ol

Base Information

• Chemical Name: 10,11-Dihydro-5-(3-dimethylamino-2-methylpropyl)-5H-dibenzo(a,d)cyclohepten-5-ol
• CAS No.: 2625-17-4
• Molecular Formula: C₂₁H₂₇NO
• Molecular Weight: 309.451
• DSSTox Substance ID: DTXSID10863002
• Nikkaji Number: J42.181B
• Mol file: 2625-17-4.mol

Synonyms:BRN 2153820;2625-17-4;10,11-Dihydro-5-(3-dimethylamino-2-methylpropyl)-5H-dibenzo(a,d)cyclohepten-5-ol;5H-Dibenzo(a,d)cyclohepten-5-ol, 10,11-dihydro-5-(3-dimethylamino-2-methylpropyl)-;5H-Dibenzo(a,d)cyclohepten-5-ol, 5-(3-(dimethylamino)-2-methylpropyl)-10,11-dihydro-;5H-Dibenzo[a,d]cyclohepten-5-ol, 5-[3-(dimethylamino)-2-methylpropyl]-10,11-dihydro-;DTXSID10863002;LS-60805;5-[3-(Dimethylamino)-2-methylpropyl]-10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ol;5-[3-(Dimethylamino)-2-methylpropyl]-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ol;5H-Dibenzo[a,d]cyclohepten-5-ol, 5-[3-(dimethylamino)-2-methylpropyl] -10,11-dihydro-

Chemical Property of 10,11-Dihydro-5-(3-dimethylamino-2-methylpropyl)-5H-dibenzo(a,d)cyclohepten-5-ol

Chemical Property:

• Vapor Pressure: 7.31E-08mmHg at 25°C
• Boiling Point: 421.6°C at 760 mmHg
• Flash Point: 186.5°C
• PSA: 23.47000
• Density: 1.065g/cm³
• LogP: 3.60890
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 309.209264485
• Heavy Atom Count: 23
• Complexity: 356

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(CC1(C2=CC=CC=C2CCC3=CC=CC=C31)O)CN(C)C

Technology Process of 10,11-Dihydro-5-(3-dimethylamino-2-methylpropyl)-5H-dibenzo(a,d)cyclohepten-5-ol

There total 2 articles about 10,11-Dihydro-5-(3-dimethylamino-2-methylpropyl)-5H-dibenzo(a,d)cyclohepten-5-ol 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:

10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-one (1210-35-1) + 3-(dimethylamino)-2-methylpropylchloride (23349-86-2) → rac.-5-Hydroxy-5-<3-dimethylamino-2-methyl-propyl>-dibenzo<1,4>cycloheptadien (2625-17-4)

Guidance literature:

Multistep reaction; (i) Mg, (ii) /BRN= 1454355/, THF;

DOI:10.1021/jo01048a057

Reference yield:

→ rac.-5-Hydroxy-5-<3-dimethylamino-2-methyl-propyl>-dibenzo<1,4>cycloheptadien (2625-17-4)

Guidance literature:

Keton II, 1. Na/NH3, 2. CH2ClCH(Me)CH2NMe2;

Reference yield:

rac.-5-Hydroxy-5-<3-dimethylamino-2-methyl-propyl>-dibenzo<1,4>cycloheptadien (2625-17-4) → rac.-5-<3-Dimethylamino-2-methyl-propyliden>-dibenzo<1,4>cycloheptadien (67195-26-0)

Guidance literature:

With acetic anhydride; Heating;

DOI:10.1021/jo01048a057

upstream raw materials:

10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-one

3-(dimethylamino)-2-methylpropylchloride

Downstream raw materials:

rac.-5-<3-Dimethylamino-2-methyl-propyliden>-dibenzo<1,4>cycloheptadien

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