(alpha-Methylbenzyl)dimethylamine

Base Information

• Chemical Name: (alpha-Methylbenzyl)dimethylamine
• CAS No.: 2449-49-2
• Molecular Formula: C₁₀H₁₅N
• Molecular Weight: 149.236
• Hs Code.: 2921499090
• European Community (EC) Number: 219-511-7
• NSC Number: 244368,8396
• DSSTox Substance ID: DTXSID70862950
• Nikkaji Number: J36.101A
• Metabolomics Workbench ID: 45359
• Mol file: 2449-49-2.mol

Synonyms:2449-49-2;N,N-DIMETHYL-1-PHENYLETHYLAMINE;(alpha-Methylbenzyl)dimethylamine;N,N-Dimethyl-1-phenylethanamine;1-Dimethylamino-1-phenylethane;alpha-Methylbenzyldimethylamine;N,N,alpha-Trimethylbenzylamine;N,N-Dimethyl-alpha-phenylethylamine;N,N-Dimethyl-alpha-methylbenzylamine;CCRIS 6694;Benzylamine, N,N,alpha-trimethyl-;NSC 8396;EINECS 219-511-7;dimethyl(1-phenylethyl)amine;N N,alpha-Trimethylbenzylamine;(.alpha.-Methylbenzyl)dimethylamine;(S)-N,N,alpha-Trimethylbenzylamine;Benzylamine, N,N,.alpha.-trimethyl-;N,N-Dimethyl-.alpha.-phenylethylamine;N,N-Dimethyl-.alpha.-methylbenzylamine;Benzenemethanamine, N,N,alpha-trimethyl-;Benzenemethanamine, N,N,.alpha.-trimethyl-;N,N-Dimethyl-1-phenylethanamine #;EINECS 241-310-8;NSC8396;R-(+)-N,N-Dimethyl-1-phenylethylamine;(R)-(+)-N,N-Dimethyl-1-phenethylamine;N,N'-DIMETHYL-alpha-METHYLBENZYLAMINE;Dimethyl-Benzeneethanamine;N,N-Dimethyl-Phenethylamine;N,N,|A-trimethylbenzylamine;SCHEMBL366705;Phenylethylamine, N,N-dimethyl;N,N,alpha-Trimethyl-Benzylamine;WLN: 1YR&N1&1;DTXSID70862950;N,N,alpha-trimethyl benzyl amine;(alpha -methylbenzyl)dimethylamine;Benzylamine,N,.alpha.-trimethyl-;N,N-Dimethyl-beta -phenethylamine;N,N-dimethyl-(1-phenyl)ethylamine;NSC-8396;Benzylamine, N,N,alpha -trimethyl-;N,N-dimethyl-1-phenylethan-1-amine;MFCD00064770;NSC244368;N,N-Dimethyl-alpha -methylbenzylamine;AKOS025294982;N, N-Dimethyl-alpha -phenylethylamine;N,N,alpha-Trimethyl-Benzenemethanamine;NSC-244368;Benzenemethanamine,N,.alpha.-trimethyl-;LS-43423;Benzenemethanamine, N,N, alpha -trimethyl-;FT-0634291;FT-0637520;FT-0771632;N,N-Dimethyl-1-phenylethylamine, AldrichCPR;Benzenemethanamine, N,N,alpha-trimethyl- (9CI);EN300-6734290;7398-61-0

Chemical Property of (alpha-Methylbenzyl)dimethylamine

Chemical Property:

• Vapor Pressure: 0.568mmHg at 25°C
• Melting Point: 143°C (estimate)
• Refractive Index: 1.509
• Boiling Point: 189.5°Cat760mmHg
• PKA: 8.88±0.50(Predicted)
• Flash Point: 64.4°C
• PSA: 3.24000
• Density: 0.914g/cm³
• LogP: 2.30920
• Sensitive.: Air & Light Sensitive
• Solubility.: H2O: soluble
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 149.120449483
• Heavy Atom Count: 11
• Complexity: 103

Purity/Quality:

99% ^*data from raw suppliers

N N,ALPHA-TRIMETHYLBENZYLAMINE 97.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 20/21/22-52-36-22
• Safety Statements: 36-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC=CC=C1)N(C)C

Technology Process of (alpha-Methylbenzyl)dimethylamine

There total 44 articles about (alpha-Methylbenzyl)dimethylamine 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: 97.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + rac-methylbenzylamine (618-36-0) → dimethyl(1-phenylethyl)amine (2449-49-2,7398-61-0,17279-31-1,19342-01-9)

Guidance literature:

formaldehyd; rac-methylbenzylamine; With hydrogenchloride; In methanol; at 20 ℃;

With N-methylpiperidine zinc borohydride; In methanol; at 20 ℃; for 0.25h;

DOI:10.1080/00397910600943667

Reference yield: 95.0%

methanol (67-56-1) + rac-methylbenzylamine (618-36-0) → dimethyl(1-phenylethyl)amine (2449-49-2,7398-61-0,17279-31-1,19342-01-9)

Guidance literature:

With 10wt%Cu-5wt%Co/γ-Al₂O₃; at 190 ℃; for 4h; Autoclave; Inert atmosphere;

Reference yield: 89.0%

carbon dioxide (124-38-9,18923-20-1) + rac-methylbenzylamine (618-36-0) → dimethyl(1-phenylethyl)amine (2449-49-2,7398-61-0,17279-31-1,19342-01-9)

Guidance literature:

With diphenylsilane; C₂₁H₄₁N₃NiP₂; In acetonitrile; at 120 ℃; for 24h; under 2052.14 Torr; Autoclave;

DOI:10.1039/c8cc05948a

upstream raw materials:

methyl magnesium iodide

diethyl ether

2-(N,N-dimethylamino)-2-phenylacetonitrile

formaldehyd

Downstream raw materials:

dimethyl-(1-phenyl-ethyl)-amine oxide

α-methylbenzyl trimethyl ammonium iodide

Hexadecyl-dimethyl-(1-phenyl-ethyl)-ammonium; bromide

N,N,N-trimethyl-1-phenylethan-1-aminium bromide

Refernces

• 1、 -. "Preparation method of N-alkylated derivative of primary amine compound". Paragraph 0021; 0053. . Retrieved 2021/07/09.
• 2、 Baba, Souya,Hirano, Kazuki,Tayama, Eiji. "Base-induced Sommelet–Hauser rearrangement of N-(α-(2-oxyethyl)branched)benzylic glycine ester-derived ammonium salts via a chelated intermediate". supporting information. . Retrieved 2020/03/13.