Benzene, 1-(1-azidoethyl)-4-methoxy-

Base Information

• Chemical Name: Benzene, 1-(1-azidoethyl)-4-methoxy-
• CAS No.: 91633-30-6
• Molecular Formula: C9H11N3O
• Molecular Weight: 177.206
• DSSTox Substance ID: DTXSID90537057
• Nikkaji Number: J2.524.584I
• Mol file: 91633-30-6.mol

Synonyms:1-(1-Azidoethyl)-4-methoxybenzene;91633-30-6;SCHEMBL19435760;DTXSID90537057

Chemical Property of Benzene, 1-(1-azidoethyl)-4-methoxy-

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 177.090211983
• Heavy Atom Count: 13
• Complexity: 193

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C1=CC=C(C=C1)OC)N=[N+]=[N-]

Technology Process of Benzene, 1-(1-azidoethyl)-4-methoxy-

There total 28 articles about Benzene, 1-(1-azidoethyl)-4-methoxy- 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: 98.0%

rac-1-(4-methoxyphenyl)-ethanol (3319-15-1) → 1-(1-azidoethyl)-4-methoxybenzene (91633-30-6)

Guidance literature:

With bismuth(lll) trifluoromethanesulfonate; trimethylsilylazide; In dichloromethane; at 20 ℃; for 0.0833333h;

DOI:10.1055/s-0034-1379967 DOI:10.1055/s-0034-1379967

Reference yield: 94.0%

methyllithium (917-54-4) + 4-methoxy-benzaldehyde (123-11-5) → 1-(1-azidoethyl)-4-methoxybenzene (91633-30-6)

Guidance literature:

With diphenyl phosphoryl azide; In tetrahydrofuran; diethyl ether; at 0 - 40 ℃; for 0.0833333h; Schlenk technique; Inert atmosphere;

DOI:10.1002/ejoc.201600856

Reference yield: 88.0%

1-methoxy-4-(1-trimethylsiloxyethyl)benzene → 1-(1-azidoethyl)-4-methoxybenzene (91633-30-6)

Guidance literature:

With iron(III) chloride; trimethylsilylazide; In 1,2-dichloro-ethane; at 20 ℃; for 0.25h; Reagent/catalyst;

DOI:10.1002/chem.201202984

upstream raw materials:

methanol

1-(4-methoxyphenyl)ethyl 4-nitrobenzoate

methoxyacetic acid sodium salt

1-(4-methoxyphenyl)ethyl 3,5-dinitrobenzoate

Downstream raw materials:

1-(4-methoxyphenyl)ethanamine

1-(4-methoxyphenyl)ethyl carbocation

1-(4-methoxyphenyl)ethan-1-amine hydrochloride

N-ethyl-4-methoxy-N-(1-(4-methoxyphenyl)ethyl)aniline