4-Chlorobenzhydrylamine hydrochloride

Base Information

• Chemical Name: 4-Chlorobenzhydrylamine hydrochloride
• CAS No.: 5267-39-0
• Molecular Formula: C13H12ClN^.HCl
• Molecular Weight: 254.159
• Hs Code.: 2921499090
• European Community (EC) Number: 226-085-6
• UNII: 6HXS6SX6FS
• NSC Number: 23816
• Mol file: 5267-39-0.mol

Synonyms:5267-39-0;4-Chlorobenzhydrylamine hydrochloride;(4-Chlorophenyl)(phenyl)methanamine hydrochloride;4-Chlorobenzhydrylamine HCl;4-Chlorobenzhydrylamine, HCl;(4-chlorophenyl)-phenylmethanamine;hydrochloride;MFCD00013024;NSC 23816;6HXS6SX6FS;(4-chlorophenyl)-phenyl-methanamine hydrochloride;SCHEMBL1143208;benzenemethanamine, 4-chloro-alpha-phenyl-, hydrochloride;NSC23816;p-chlorobenzhydrylamine hydrochloride;NSC-23816;AKOS008937294;AC-1717;CS-W012598;SB47178;SB47480;4-Chloro-a-phenyl-benzenemethanamine HCl;rac-4-chlorobenzhydrylamine hydrochloride;AS-68129;SY004669;4-Chlorobenzhydrylamine hydrochloride, 98%;NS00045390;EN300-35550;p-Chloro-alpha-phenylbenzylamine hydrochloride;N12015;(4-Chlorophenyl)(phenyl)methanaminehydrochloride;(4-chlorophenyl)-phenylmethanamine hydrochloride;A829197;Benzylamine, p-chloro-alpha-phenyl-, hydrochloride;(4-chlorophenyl) (phenyl) methanamine hydrochloride;1-(4-chlorophenyl)-1-phenylmethanamine hydrochloride;C-(4-chloro-phenyl)-C-phenyl-methylamine hydrochloride;Z367452252;(4-Chlorophenyl)(phenyl)methanamine hydrochloride, (+/-)-;Benzenemethanamine, 4-chloro-alpha-phenyl-, hydrochloride (1:1)

Chemical Property of 4-Chlorobenzhydrylamine hydrochloride

Chemical Property:

• Vapor Pressure: 0.000109mmHg at 25°C
• Melting Point: 300-305 °C (dec.)(lit.)
• Boiling Point: 336.8 °C at 760 mmHg
• Flash Point: 199.3 °C
• PSA: 26.02000
• Density: 1.175g/cm3
• LogP: 4.89040
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 253.0425048
• Heavy Atom Count: 16
• Complexity: 181

Purity/Quality:

99% ^*data from raw suppliers

4-Chlorobenzhydrylamine hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)N.Cl

Technology Process of 4-Chlorobenzhydrylamine hydrochloride

There total 7 articles about 4-Chlorobenzhydrylamine 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: 93.0%

1-(4-chlorophenyl)-N-(diphenylmethylene)-1-phenylmethanamine → 4-chlorobenzhydrylamine hydrochloride (5267-39-0,451503-28-9,451503-29-0)

Guidance literature:

With hydrogenchloride; In tetrahydrofuran; water; at 0 - 20 ℃; Inert atmosphere;

DOI:10.1039/c3sc53526f

Reference yield: 80.0%

→ 4-chlorobenzhydrylamine hydrochloride (5267-39-0,451503-28-9,451503-29-0)

Guidance literature:

Reference yield:

benzhydrylidene-benzyl-amine (7699-79-8) → 4-chlorobenzhydrylamine hydrochloride (5267-39-0,451503-28-9,451503-29-0)

Guidance literature:

Multi-step reaction with 2 steps

1: palladium diacetate; nixantphos; sodium hexamethyldisilazane / 3 h / 24 °C / Inert atmosphere

2: hydrogenchloride / tetrahydrofuran; water / 0 - 20 °C / Inert atmosphere

With hydrogenchloride; palladium diacetate; sodium hexamethyldisilazane; nixantphos; In tetrahydrofuran; water;

DOI:10.1039/c3sc53526f

upstream raw materials:

benzhydrylidene-benzyl-amine

1-(4-chlorophenyl)-N-(diphenylmethylene)methanamine

bromobenzene

bromochlorobenzene

Downstream raw materials:

N-[Bis-(4-chlorophenyl)methyl]-4-(4,4,4-trifluoro-3-oxo-1-butyl)-phenoxyacetamide

p-chlorobenzhydrylurea

ethyl ((4-chlorophenyl)(phenyl)methyl)carbamate

1,3-bis((4-chlorophenyl)(phenyl)methyl)urea

Refernces

• 1、 -. "METHODS OF PREPARING PRIMARY, SECONDARY AND TERTIARY CARBINAMINE COMPOUNDS IN THE PRESENCE OF AMMONIA". Page/Page column 53-54; 64. . Retrieved 2008/12/04.