5H-Dibenzo(a,d)cycloheptene-4-propylamine, 10,11-dihydro-N,N-dimethyl-5-methylene-

Base Information

• Chemical Name: 5H-Dibenzo(a,d)cycloheptene-4-propylamine, 10,11-dihydro-N,N-dimethyl-5-methylene-
• CAS No.: 36065-46-0
• Molecular Formula: C₂₁H₂₅N
• Molecular Weight: 291.436
• DSSTox Substance ID: DTXSID40189641
• Nikkaji Number: J42.176F
• Wikidata: Q83061817
• Mol file: 36065-46-0.mol

Synonyms:BRN 2947806;36065-46-0;5H-Dibenzo(a,d)cycloheptene-4-propylamine, 10,11-dihydro-N,N-dimethyl-5-methylene-;10,11-Dihydro-N,N-dimethyl-5-methylene-5H-dibenzo(a,d)cycloheptene-4-propylamine;DTXSID40189641;LS-60750;10,11-Dihydro-N,N-dimethyl-5-methylene-5H-dibenzo[a,d]cycloheptene-4-(1-propanamine);5H-Dibenzo[a,d]cycloheptene-4-propanamine, 10,11-dihydro-N,N-dimethyl-5-methylene-

Chemical Property of 5H-Dibenzo(a,d)cycloheptene-4-propylamine, 10,11-dihydro-N,N-dimethyl-5-methylene-

Chemical Property:

• Vapor Pressure: 3.53E-07mmHg at 25°C
• Boiling Point: 417.5°Cat760mmHg
• Flash Point: 183.5°C
• PSA: 3.24000
• Density: 1.04g/cm³
• LogP: 4.34090
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 291.198699802
• Heavy Atom Count: 22
• Complexity: 372

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCCC1=CC=CC2=C1C(=C)C3=CC=CC=C3CC2

Technology Process of 5H-Dibenzo(a,d)cycloheptene-4-propylamine, 10,11-dihydro-N,N-dimethyl-5-methylene-

There total 7 articles about 5H-Dibenzo(a,d)cycloheptene-4-propylamine, 10,11-dihydro-N,N-dimethyl-5-methylene- 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:

N,N-Dimethyl-3'-<10,11-dihydro-5-methylen-5H-dibenzocyclohepten-4>-propionamid (36065-56-2) → N,N-Dimethyl-3'-<10,11-dihydro-5-methylen-5H-dibenzocyclohepten-4>-propylamin (36065-46-0)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran;

DOI:10.1021/jm00292a024

Reference yield:

10,11-Dihydro-5-methylen-5H-dibenzocyclohepten-4-methylchlorid (36065-51-7) → N,N-Dimethyl-3'-<10,11-dihydro-5-methylen-5H-dibenzocyclohepten-4>-propylamin (36065-46-0)

Guidance literature:

Multi-step reaction with 4 steps

1: (i) NaOEt, EtOH, (ii) /BRN= 1969585/

2: (i) aq. KOH, EtOH, (ii) (heating)

3: (i) SOCl₂, DMF, (ii) /BRN= 3589311/, aq. NaOH, benzene

4: LiAlH₄ / tetrahydrofuran

With lithium aluminium tetrahydride; In tetrahydrofuran;

DOI:10.1021/jm00292a024

Reference yield:

3-<10,11-Dihydro-5-methylen-5H-dibenzocyclohepten-4>-propionsaeure (36065-55-1) → N,N-Dimethyl-3'-<10,11-dihydro-5-methylen-5H-dibenzocyclohepten-4>-propylamin (36065-46-0)

Guidance literature:

Multi-step reaction with 2 steps

1: (i) SOCl₂, DMF, (ii) /BRN= 3589311/, aq. NaOH, benzene

2: LiAlH₄ / tetrahydrofuran

With lithium aluminium tetrahydride; In tetrahydrofuran;

DOI:10.1021/jm00292a024

upstream raw materials:

N,N-Dimethyl-3'-<10,11-dihydro-5-methylen-5H-dibenzocyclohepten-4>-propionamid

10,11-Dihydro-5-methylen-5H-dibenzocyclohepten-4-methylchlorid

3-<10,11-Dihydro-5-methylen-5H-dibenzocyclohepten-4>-propionsaeure

Diethyl <10,11-dihydro-5-methylen-5H-dibenzocyclohepten-4> methylenmalonat

Downstream raw materials:

Methyl-[3-(5-methylene-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-4-yl)-propyl]-carbamic acid ethyl ester

N-Methyl-3-(10.12-dihydro-5-methylen-5H-dibenzo[a.d]cyclohepten-4)-propylamin