N-(4-methoxybenzyl)-N-methylmethanesulfonamide

Base Information

• Chemical Name: N-(4-methoxybenzyl)-N-methylmethanesulfonamide
• CAS No.: 34825-81-5
• Molecular Formula: C10H15NO3S
• Molecular Weight: 229.3
• European Community (EC) Number: 810-538-5
• DSSTox Substance ID: DTXSID401208899
• Mol file: 34825-81-5.mol

Synonyms:N-(4-methoxybenzyl)-N-methylmethanesulfonamide;34825-81-5;N-[(4-methoxyphenyl)methyl]-N-methylmethanesulfonamide;EC 810-538-5;SCHEMBL11609;DTXSID401208899;HMS1604N03;MFCD08069352;AKOS008941603;AS-67046;CS-0451457;FT-0754673;EN300-123727;A1-24652;Z45593155

Chemical Property of N-(4-methoxybenzyl)-N-methylmethanesulfonamide

Chemical Property:

• PSA: 54.99000
• LogP: 2.16740
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 229.07726451
• Heavy Atom Count: 15
• Complexity: 276

Purity/Quality:

99.9% ^*data from raw suppliers

N-(4-Methoxybenzyl)-N-methylmethanesulfonamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(CC1=CC=C(C=C1)OC)S(=O)(=O)C

Technology Process of N-(4-methoxybenzyl)-N-methylmethanesulfonamide

There total 7 articles about N-(4-methoxybenzyl)-N-methylmethanesulfonamide 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: 95.0%

4-methoxy-N-methylbenzylamine (702-24-9) + methanesulfonyl chloride (124-63-0) → N-[(4-methoxyphenyl)methyl]-N-(methyl)methanesulfonamide (34825-81-5)

Guidance literature:

With triethylamine; In toluene; at 25 - 30 ℃; for 3h; Inert atmosphere;

DOI:10.1021/acs.orglett.6b01793

Reference yield: 90.0%

N-(4-methoxybenzyl)-methanesulfonamide (42060-31-1) + methyl iodide (74-88-4) → N-[(4-methoxyphenyl)methyl]-N-(methyl)methanesulfonamide (34825-81-5)

Guidance literature:

N-(4-methoxybenzyl)-methanesulfonamide; With sodium hydride; In mineral oil; at 0 ℃; for 0.5h;

methyl iodide; In mineral oil; at 0 - 18 ℃; for 1.5h;

Reference yield:

4-methoxy-benzaldehyde (123-11-5) + methanesulfonyl chloride (124-63-0) + methylamine (74-89-5) → N-[(4-methoxyphenyl)methyl]-N-(methyl)methanesulfonamide (34825-81-5)

Guidance literature:

4-methoxy-benzaldehyde; methylamine; In methanol; ethanol; at 0 - 20 ℃; Large scale;

With sodium tetrahydroborate; In tetrahydrofuran; methanol; ethanol; for 8h; Large scale;

methanesulfonyl chloride; Further stages; Large scale;

upstream raw materials:

4-methoxy-N-methylbenzylamine

methanesulfonyl chloride

4-methoxy-benzylamine

N-(4-methoxybenzyl)-methanesulfonamide

Downstream raw materials:

C₁₆H₁₉NO₃S

C₃₀H₃₅F₃N₄O₄S₂

C₁₆H₁₈F₅NO₃S₂

(R)-2-((S)-1,1-dimethylethylsulfinamido)-N-(4-methoxybenzyl)-N-methyl-2-(2,4,6-trifluorophenyl)propane-1-sulfonamide