3-(Dimethylamino)propanoic acid hydrochloride

Base Information

• Chemical Name: 3-(Dimethylamino)propanoic acid hydrochloride
• CAS No.: 14788-12-6
• Molecular Formula: C5H11 N O2 . Cl H
• Molecular Weight: 153.609
• Hs Code.: 2922499990
• European Community (EC) Number: 679-966-6
• DSSTox Substance ID: DTXSID10468970
• Mol file: 14788-12-6.mol

Synonyms:14788-12-6;3-(dimethylamino)propanoic acid hydrochloride;3-(Dimethylamino)propionic Acid Hydrochloride;3-dimethylaminopropionic acid hydrochloride;3-(dimethylamino)propanoic acid;hydrochloride;beta-Alanine, N,N-dimethyl-, hydrochloride (1:1);3-(Dimethylamino)propionic acid HCl;MFCD02093464;N,N-Dimethyl-beta-alanine Hydrochloride;3-(DIMETHYLAMINO)PROPANOIC ACID HCL;SCHEMBL445971;DTXSID10468970;3-Dimethylaminopropanoic acid HCl;3-Dimethylaminopropinoic Acid HCl;JTNKXYWGZCNBCH-UHFFFAOYSA-N;dimethyl-beta-alanine hydrochloride;AKOS015845991;AM86616;CS-W007826;GS-3831;3-(dimethylamino)propionic acid HCl salt;BP-12329;SY031864;3-(dimethylamino)propanoicacidhydrochloride;3-dimethylamino propionic acid hydrochloride;D2690;FT-0649867;3-(dimethyleamino) propionic acid hydrochloride;EN300-110453;3-(dimethylamino)propanoic acid hydrogen chloride;A846482;3-(Dimethylamino)propionic acid hydrochloride, 97%;N,N-Dimethyl-beta-alanine hydrochloride, AldrichCPR

Chemical Property of 3-(Dimethylamino)propanoic acid hydrochloride

Chemical Property:

• Vapor Pressure: 0.212mmHg at 25°C
• Melting Point: 186.0 to 192.0 °C
• Boiling Point: 192.6°C at 760 mmHg
• Flash Point: 70.3°C
• PSA: 40.54000
• LogP: 0.82470
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• Water Solubility.: almost transparency
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 153.0556563
• Heavy Atom Count: 9
• Complexity: 80.5

Purity/Quality:

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

3-(Dimethylamino)propionic Acid Hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCC(=O)O.Cl
• Uses: 3-(Dimethylamino)propionic Acid Hydrochloride is a useful reagent for the preparation of biological active small molecules.

Technology Process of 3-(Dimethylamino)propanoic acid hydrochloride

There total 3 articles about 3-(Dimethylamino)propanoic acid 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: 57.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 3-amino propanoic acid (107-95-9) → 3-(dimethylamino)propanoic acid hydrochloride (14788-12-6)

Guidance literature:

With hydrogen; palladium on activated charcoal; In water; for 24h;

DOI:10.1515/znb-1983-0820

Reference yield:

chloropropionic acid (107-94-8) + dimethyl amine (124-40-3) → 3-(dimethylamino)propanoic acid hydrochloride (14788-12-6)

Guidance literature:

DOI:10.1002/jps.2600840122

Reference yield:

→ 3-(dimethylamino)propanoic acid hydrochloride (14788-12-6)

Guidance literature:

β-Chlorpropionsaeure, KOH, Dimethylformamid, Δ (Sieden);

upstream raw materials:

formaldehyd

3-amino propanoic acid

chloropropionic acid

dimethyl amine

Downstream raw materials:

CBD 3-(dimethylamino)propionate

CBD bis(3-(dimethylamino)propionate)

Refernces

• 1、 Marston,Hecker. "Structure-activity relationships of polyfunctional diterpenes of the tigliane type V. Preparation and irritant activities of amino acid and peptide esters of phorbol". . p. 1015 - 1021. Retrieved 1983.
• 2、 Cui, Xin,Li, Zhe,Tao, Chuan-Zhou,Xu, Yu,Li, Juan,Liu, Lei,Guo, Qing-Xiang. "N,N-dimethyl-β-alanine as an inexpensive and efficient ligand for palladium-catalyzed Heck reaction". . p. 2467 - 2470. Retrieved 2007/10/03.