4-[Bis(2-chloroethyl)amino]-2-fluorobenzaldehyde

Base Information

• Chemical Name: 4-[Bis(2-chloroethyl)amino]-2-fluorobenzaldehyde
• CAS No.: 1736-39-6
• Molecular Formula: C₁₁H₁₂Cl₂FNO
• Molecular Weight: 264.127
• NSC Number: 75921
• DSSTox Substance ID: DTXSID00938410
• Wikidata: Q82914721

Synonyms:1736-39-6;4-[bis(2-chloroethyl)amino]-2-fluorobenzaldehyde;NSC75921;DTXSID00938410;NSC-75921

Chemical Property of 4-[Bis(2-chloroethyl)amino]-2-fluorobenzaldehyde

Chemical Property:

• Vapor Pressure: 1.76E-06mmHg at 25°C
• Boiling Point: 396°Cat760mmHg
• Flash Point: 193.3°C
• Density: 1.326g/cm³
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 263.0279976
• Heavy Atom Count: 16
• Complexity: 212

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1N(CCCl)CCCl)F)C=O

Technology Process of 4-[Bis(2-chloroethyl)amino]-2-fluorobenzaldehyde

There total 1 articles about 4-[Bis(2-chloroethyl)amino]-2-fluorobenzaldehyde 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:

→ 4-[bis-(2-chloro-ethyl)-amino]-2-fluoro-benzaldehyde (1736-39-6)

Guidance literature:

3-Fluor-N,N-bis-<2-hydroxy-aethyl>-anilin, POCl3, DMF, Dampfb., 1 h;

DOI:10.1021/jm00332a018

Reference yield:

4-[bis-(2-chloro-ethyl)-amino]-2-fluoro-benzaldehyde (1736-39-6) + 3-chloro-4-[2-(4-chloro-phenyl)-thiazol-4-yl]-aniline; monohydrochloride (28241-59-0) → N-{4-[bis-(2-chloro-ethyl)-amino]-2-fluoro-benzylidene}-3-chloro-4-[2-(4-chloro-phenyl)-thiazol-4-yl]-aniline

Guidance literature:

In ethanol;

DOI:10.1021/jm00299a031

Reference yield:

4-[bis-(2-chloro-ethyl)-amino]-2-fluoro-benzaldehyde (1736-39-6) + 3-chloro-4-(2-phenoxymethyl-thiazol-4-yl)-aniline; monohydrochloride (28281-00-7) → N-{4-[bis-(2-chloro-ethyl)-amino]-2-fluoro-benzylidene}-3-chloro-4-(2-phenoxymethyl-thiazol-4-yl)-aniline

Guidance literature:

In ethanol;

DOI:10.1021/jm00299a031

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