Adamantan-1-ylmethanamine hydrochloride

Base Information

• Chemical Name: Adamantan-1-ylmethanamine hydrochloride
• CAS No.: 1501-98-0
• Molecular Formula: C11H20ClN
• Molecular Weight: 201.739
• Hs Code.: 2921300090
• European Community (EC) Number: 859-300-2
• DSSTox Substance ID: DTXSID80485179
• NSC Number: 187483
• Mol file: 1501-98-0.mol

Synonyms:1501-98-0;Adamantan-1-ylmethanamine hydrochloride;1-(1-adamantyl)methanamine hydrochloride;1-adamantylmethanamine;hydrochloride;1-(1-Adamantyl)methanamine, HCl;1-Adamantylmethanamine hydrochloride;1-(ADAMANTAN-1-YL)METHANAMINE HYDROCHLORIDE;adamantanylmethylamine, chloride;SCHEMBL3027022;1-(1-Adamantyl)methanamine HCl;DTXSID80485179;SCNHINHHYKFASL-UHFFFAOYSA-N;1-adamantanemethylamine hydrochloride;ADAMANTAN-1-YLMETHANAMINE HCL;MFCD02208192;NSC187483;Adamantan-1-ylmethanaminehydrochloride;adamantylmethylamine hydrochloride salt;AKOS015917989;AKOS040768616;NSC-187483;(adamantan-1-yl)methanamine hydrochloride;CS-0183320;EN300-08182;1-(1-ADAMANTYL)METHANAMINEHYDROCHLORIDE;SR-01000400495;J-502840;SR-01000400495-1;Z56899180;Tricyclo[3.3.1.13,7]decane-1-methanamine, hydrochloride (1:1);1-(Tricyclo[3.3.1.1~3,7~]decan-1-yl)methanamine--hydrogen chloride (1/1)

Chemical Property of Adamantan-1-ylmethanamine hydrochloride

Chemical Property:

• Melting Point: 337-340℃
• Boiling Point: 280.9 °C at 760 mmHg
• Flash Point: 123.7 °C
• PSA: 26.02000
• Density: 1.039 g/cm3
• LogP: 3.66380
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 201.1284273
• Heavy Atom Count: 13
• Complexity: 156

Purity/Quality:

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

Adamantan-1-ylmethanaminehydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2CC3CC1CC(C2)(C3)CN.Cl
• Uses: Adamantan-1-ylmethanamine Hydrochloride is used in preparation of adamantanyl-substituted benzamide compounds and their use as P2X7 receptor antagonists.

Technology Process of Adamantan-1-ylmethanamine hydrochloride

There total 6 articles about Adamantan-1-ylmethanamine 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: 94.0%

1-adamantanecarbonitrile (23074-42-2) → 1-adamantylmethylamine hydrochloride (1501-98-0)

Guidance literature:

1-adamantanecarbonitrile; With ammonium hydroxide; hydrogen; In water; isopropyl alcohol; at 130 ℃; for 2h; under 30003 Torr; Autoclave;

With hydrogenchloride; In methanol;

DOI:10.1021/jacs.6b03439

Reference yield: 69.0%

adamantane-1-carboxamide (5511-18-2) → 1-adamantylmethylamine hydrochloride (1501-98-0)

Guidance literature:

adamantane-1-carboxamide; With phenylsilane; C₃₆H₄₈F₆N₆NiO₅S₂; In toluene; at 110 ℃; for 12h; Inert atmosphere; Schlenk technique;

With hydrogenchloride; In diethyl ether;

DOI:10.1039/d1cc03537a

Reference yield: 60.0%

adamantylmethylamine (17768-41-1) → 1-adamantylmethylamine hydrochloride (1501-98-0)

Guidance literature:

With hydrogenchloride; In dichloromethane; at 0 ℃;

upstream raw materials:

adamantylmethylamine

1-adamantanecarbonitrile

adamantane-1-carboxamide

1-Adamantanecarboxylic acid

Downstream raw materials:

N-adamantan-1-ylmethyl-(2-chloro-5-methoxy)-benzamide

1-((adamantan-1-yl)methyl)-3-phenylurea

Refernces

• 1、 Pandey, Pragati,Bera, Jitendra K.. "Hydrosilylative reduction of primary amides to primary amines catalyzed by a terminal [Ni-OH] complex". supporting information. p. 9204 - 9207. Retrieved 2021/09/20.
• 2、 -. "ADAMANTANYL-SUBSTITUTED BENZAMIDE COMPOUNDS AND THEIR USE AS P2X7 RECEPTOR ANTAGONISTS". Page/Page column 20; 22-23. . Retrieved 2020/03/15.