2-(Methanesulfonyl)benzylamine hydrochloride

Base Information

• Chemical Name: 2-(Methanesulfonyl)benzylamine hydrochloride
• CAS No.: 342816-14-2
• Molecular Formula: C8H11NO2S.ClH
• Molecular Weight: 221.708
• Hs Code.: 2921499090
• European Community (EC) Number: 693-937-5
• DSSTox Substance ID: DTXSID90584884
• Mol file: 342816-14-2.mol

Synonyms:2-(Methanesulfonyl)benzylamine hydrochloride;342816-14-2;(2-methylsulfonylphenyl)methanamine;hydrochloride;(2-(Methylsulfonyl)phenyl)methanamine hydrochloride;2-methylsulfonylbenzylamine hydrochloride;SCHEMBL567914;DTXSID90584884;ITWDFVUNCISBDX-UHFFFAOYSA-N;2-Methanesulfonyl-benzylamine hydrochloride;EN300-254634;[2-(Methylsulfonyl)phenyl]methanaminium chloride;2-(Methanesulfonyl)benzylamine hydrochloride, 97%;1-[2-(methylsulfonyl)phenyl]methanamine hydrochloride;(2-METHANESULFONYLPHENYL)METHANAMINE HYDROCHLORIDE;1-[2-(Methanesulfonyl)phenyl]methanamine--hydrogen chloride (1/1)

Chemical Property of 2-(Methanesulfonyl)benzylamine hydrochloride

Chemical Property:

• Melting Point: 239-243°C
• PSA: 68.54000
• LogP: 3.13190
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 221.0277275
• Heavy Atom Count: 13
• Complexity: 230

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-(Methanesulfonyl)benzylamine hydrochloride 97% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36/37/38
• Safety Statements: 26

MSDS Files:

Useful:

• Canonical SMILES: CS(=O)(=O)C1=CC=CC=C1CN.Cl

Technology Process of 2-(Methanesulfonyl)benzylamine hydrochloride

There total 2 articles about 2-(Methanesulfonyl)benzylamine hydrochloride 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:

2-(methylsulfonyl)benzonitrile (89942-56-3) → 1-[2-(methylsulfonyl)phenyl]methanamine hydrochloride (342816-14-2)

Guidance literature:

With hydrogenchloride; hydrogen; palladium 10% on activated carbon; In 1,4-dioxane; methanol; for 4h;

Reference yield:

(2-methanesulfonyl-benzyl)-carbamic acid tert-butyl ester (342816-13-1) + argon → 1-[2-(methylsulfonyl)phenyl]methanamine hydrochloride (342816-14-2)

Guidance literature:

With HCl (g); In dichloromethane;

Reference yield: 81.0%

2-(1-(di-tert-butoxycarbonylamino)isoquinolin-6-ylamino)-2-(3-bromophenyl)acetic acid (918811-19-5) + 1-[2-(methylsulfonyl)phenyl]methanamine hydrochloride (342816-14-2) → N-(2-(methylsulfonyl)benzyl)-2-(3-bromophenyl)-2-(1-(di-tert-butoxycarbonylamino)isoquinolin-6-ylamino)acetamide (918811-20-8)

Guidance literature:

With 1-hydroxy-7-aza-benzotriazole; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In dichloromethane; N,N-dimethyl-formamide; at 20 ℃;

upstream raw materials:

(2-methanesulfonyl-benzyl)-carbamic acid tert-butyl ester

2-(methylsulfonyl)benzonitrile

Downstream raw materials:

N-(2-(methylsulfonyl)benzyl)-2-(3-bromophenyl)-2-(1-(di-tert-butoxycarbonylamino)isoquinolin-6-ylamino)acetamide

N-(2-(methylsulfonyl)benzyl)-2-(1-(di-tert-butoxycarbonylamino)isoquinolin-6-ylamino)-2-(3-methoxyphenyl)acetamide

N-(2-(methylsulfonyl)benzyl)-2-(1-(di-tert-butoxycarbonylamino)isoquinolin-6-ylamino)-2-(3-methylthiophenyl)acetamide

5-chloro-2-imino-1-[2-(methylsulfonyl)benzyl]-1,2-dihydropyridine-3-carboxamide hydrochloride