Benzylamine hydrochloride

Base Information

• Chemical Name: Benzylamine hydrochloride
• CAS No.: 3287-99-8
• Deprecated CAS: 2366968-95-6
• Molecular Formula: C₇H₁₀N*Cl
• Molecular Weight: 143.616
• Hs Code.: 29214980
• European Community (EC) Number: 221-943-6
• NSC Number: 146463
• UNII: VXG5QED8TV
• DSSTox Substance ID: DTXSID70879109
• ChEMBL ID: CHEMBL14186
• Mol file: 3287-99-8.mol

Synonyms:benzylamine;benzylamine hydrobromide;benzylamine hydrochloride;benzylamine monosulfate

Chemical Property of Benzylamine hydrochloride

Chemical Property:

• Appearance/Colour: white crystal or crystalline powder
• Vapor Pressure: 0.713mmHg at 25°C
• Melting Point: 262-263 °C(lit.)
• Boiling Point: 185 °C at 760 mmHg
• Flash Point: 60 °C
• PSA: 26.02000
• LogP: 2.64760
• Storage Temp.: Store below +30°C.
• Sensitive.: Hygroscopic
• Solubility.: 506g/l (experimental)
• Water Solubility.: SOLUBLE
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 143.0501770
• Heavy Atom Count: 9
• Complexity: 55.4

Purity/Quality:

99% ^*data from raw suppliers

Benzylamine hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn, Xi
• Hazard Codes: Xn,Xi
• Statements: 22-37/38-41-36/37/38
• Safety Statements: 26-36/37/39-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Nitrogen Compounds -> Amines, Aromatic
• Canonical SMILES: C1=CC=C(C=C1)CN.Cl
• Uses: inhibitor of bovine serum oxidase; irritant

Technology Process of Benzylamine hydrochloride

There total 68 articles about 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: 100.0%

benzylamine (100-46-9) → benzylamine hydrochloride (3287-99-8,39110-74-2,108321-65-9)

Guidance literature:

With hydroxylamine hydrochloride; In ethanol; for 2h; Reflux;

DOI:10.1080/00397911.2015.1096943

Reference yield: 100.0%

benzonitrile (100-47-0) → benzylamine hydrochloride (3287-99-8,39110-74-2,108321-65-9)

Guidance literature:

With hydrogenchloride; hydrogen; In propan-1-ol; water; at 60 ℃; for 18h; under 375.038 Torr; Flow reactor;

DOI:10.1002/open.201600166

Reference yield: 99.0%

1-nitro-1-phenylmethane (622-42-4) → benzylamine hydrochloride (3287-99-8,39110-74-2,108321-65-9)

Guidance literature:

1-nitro-1-phenylmethane; With triethyl borane; potassium tert-butylate; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; In tetrahydrofuran; at 100 ℃; for 24h; Inert atmosphere; Sealed tube; Green chemistry;

With hydrogenchloride; In water; at 20 ℃; for 6h; Green chemistry;

upstream raw materials:

chloroacetic acid ethyl ester

benzylamine

acetyl chloride

N,N-dibenzylhydroxylamine

Downstream raw materials:

N-benzyl-N-[(5-methyl-2-furyl)methyl]amine

N-benzyl-4-aminopyridine

3-benzylaminomethyl-7-chloro-chroman-4-one

5,5'-dibenzyl-1,1'-(4-oxa-heptanediyl)-bis-biguanide; dihydrochloride

Refernces

• 1、 Darcel, Christophe,Wu, Jiajun. "Tandem Fe/Zn or Fe/In Catalysis for the Selective Synthesis of Primary and Secondary Amines?via Selective Reduction of Primary Amides". . . Retrieved 2022/03/18.
• 2、 Sarkar, Koushik,Das, Kuhali,Kundu, Abhishek,Adhikari, Debashis,Maji, Biplab. "Phosphine-Free Manganese Catalyst Enables Selective Transfer Hydrogenation of Nitriles to Primary and Secondary Amines Using Ammonia-Borane". . p. 2786 - 2794. Retrieved 2021/03/03.