N-[(2-chlorophenyl)methyl]-3-(imidazol-1-ylmethyl)aniline

Base Information

Chemical Name:N-[(2-chlorophenyl)methyl]-3-(imidazol-1-ylmethyl)aniline
CAS No.:120107-94-0
Molecular Formula:C₁₇H₁₆ClN₃
Molecular Weight:297.787
Hs Code.:
DSSTox Substance ID:DTXSID301175883

Synonyms:N-[(2-chlorophenyl)methyl]-3-(imidazol-1-ylmethyl)aniline;DTXSID301175883;120107-94-0;2-Chloro-N-[3-(1H-imidazol-1-ylmethyl)phenyl]benzenemethanamine;Benzenemethanamine, 2-chloro-N-[3-(1H-imidazol-1-ylmethyl)phenyl]-

Suppliers and Price of N-[(2-chlorophenyl)methyl]-3-(imidazol-1-ylmethyl)aniline

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of N-[(2-chlorophenyl)methyl]-3-(imidazol-1-ylmethyl)aniline

Chemical Property:

XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:297.1032752
Heavy Atom Count:21
Complexity:312

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C(=C1)CNC2=CC=CC(=C2)CN3C=CN=C3)Cl

Technology Process of N-[(2-chlorophenyl)methyl]-3-(imidazol-1-ylmethyl)aniline

There total 4 articles about N-[(2-chlorophenyl)methyl]-3-(imidazol-1-ylmethyl)aniline 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: 40.0%

: 120107-86-0
[1-(2-Chloro-phenyl)-meth-(E)-ylidene]-(3-imidazol-1-ylmethyl-phenyl)-amine

: 120107-94-0
(2-Chloro-benzyl)-(3-imidazol-1-ylmethyl-phenyl)-amine

Guidance literature:: With sodium tetrahydroborate; In ethanol; for 2h; Heating;
DOI:10.1016/0223-5234(88)90201-2

Reference yield:

: 3958-57-4
1-bromomethyl-3-nitrobenzene

: 120107-94-0
(2-Chloro-benzyl)-(3-imidazol-1-ylmethyl-phenyl)-amine

Guidance literature:: Multi-step reaction with 4 steps

1: 70 percent / Na₂CO₃ / CHCl₃ / 6 h / Heating

2: 80 percent / H₂ / 10percent Pd/C / ethyl acetate / 60 °C

3: 50 percent / glacial acetic acid / ethanol; benzene / 24 h / Heating

4: 40 percent / NaBH₄ / ethanol / 2 h / Heating

With sodium tetrahydroborate; hydrogen; sodium carbonate; acetic acid; palladium on activated charcoal; In ethanol; chloroform; ethyl acetate; benzene;
DOI:10.1016/0223-5234(88)90201-2

Reference yield:

: 56643-75-5
1-(3-nitro-benzyl)-1H-imidazole

: 120107-94-0
(2-Chloro-benzyl)-(3-imidazol-1-ylmethyl-phenyl)-amine

Guidance literature:: Multi-step reaction with 3 steps

1: 80 percent / H₂ / 10percent Pd/C / ethyl acetate / 60 °C

2: 50 percent / glacial acetic acid / ethanol; benzene / 24 h / Heating

3: 40 percent / NaBH₄ / ethanol / 2 h / Heating

With sodium tetrahydroborate; hydrogen; acetic acid; palladium on activated charcoal; In ethanol; ethyl acetate; benzene;
DOI:10.1016/0223-5234(88)90201-2