Methyl 5-aminopentanoate hydrochloride

Base Information

• Chemical Name: Methyl 5-aminopentanoate hydrochloride
• CAS No.: 29840-56-0
• Molecular Formula: C6H14ClNO2

• Molecular Weight: 167.636
• Hs Code.: 2922499990
• European Community (EC) Number: 817-170-4
• DSSTox Substance ID: DTXSID00546357
• Mol file: 29840-56-0.mol

Synonyms:Methyl 5-aminopentanoate hydrochloride;29840-56-0;Methyl 5-Aminopentanoate HCl;methyl 5-aminovalerate hydrochloride;methyl 5-aminopentanoate;hydrochloride;MFCD13368250;5-AminopentanoicAcidMethylEsterHydrochloride-d4;5-aminopentanoic acid methyl ester hydrochloride;5-Aminopentanoic acid methyl ester HCl;SCHEMBL516410;Pentanoic acid, 5-amino-, methyl ester, hydrochloride;DTXSID00546357;FAKIZCQRTPAOSH-UHFFFAOYSA-N;Methyl5-aminopentanoatehydrochloride;BCP22357;methyl 5-aminopentanate hydrochloride;Methyl-5-aminopentanoate hydrochloride;AKOS016009957;methyl 5-azanylpentanoate hydrochloride;AC-6343;FM-0753;Methyl 5-amino-pentanoate hydrochloride;5-Amino-pentanoic acid methyl ester HCl;SY117564;CS-0018002;5-aminovaleric acid methyl ester hydrochloride;EN300-56454;5-aminopentanoic acid, methyl ester, hydrochloride;A820069;Methyl 5-aminopentanoate--hydrogen chloride (1/1);Z854942764

Chemical Property of Methyl 5-aminopentanoate hydrochloride

Chemical Property:

• Vapor Pressure: 0.146mmHg at 25°C
• Melting Point: 145.5-147℃
• Boiling Point: 212.2°C at 760 mmHg
• Flash Point: 82.1°C
• PSA: 52.32000
• LogP: 1.79070
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• Solubility.: DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly)
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 167.0713064
• Heavy Atom Count: 10
• Complexity: 83.1

Purity/Quality:

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

Methyl5-AminopentanoateHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCCCN.Cl
• Uses: Methyl 5-Aminopentanoate Hydrochloride is used as a reactant to synthesize several compounds with therapeutic potential.

Technology Process of Methyl 5-aminopentanoate hydrochloride

There total 6 articles about Methyl 5-aminopentanoate 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%

methanol (67-56-1) + 5-amino-valeric acid ; hydrochloride (627-95-2) → 5-aminopentanoic acid methyl ester hydrochloride (29840-56-0)

Guidance literature:

With acetyl chloride; at 0 ℃; Inert atmosphere; Reflux;

DOI:10.1021/acs.jmedchem.6b01642

Reference yield: 97.0%

methanol (67-56-1) + 5-aminopentanoic acid (660-88-8) → 5-aminopentanoic acid methyl ester hydrochloride (29840-56-0)

Guidance literature:

With thionyl chloride; Heating;

DOI:10.1021/jm060290f

Reference yield: 82.0%

methanol (67-56-1) + 4-amino-n-butyric acid (56-12-2) → 5-aminopentanoic acid methyl ester hydrochloride (29840-56-0)

Guidance literature:

With thionyl chloride; at 0 - 20 ℃;

DOI:10.1039/d0ob01337d

upstream raw materials:

methanol

5-aminopentanoic acid

2,2-dimethoxy-propane

piperidin-2-one

Downstream raw materials:

methyl 5-[5-(3-tert-butoxycarbonylaminophenyl)-3-isoxazolecarboxamido]pentanoate

methyl 5-[5-(4-tert-butoxycarbonylaminophenyl)-3-isoxazolecarboxamido]pentanoate

methyl 5-[[[(3R,5S)-7-chloro-5-(2,3-dimethoxyphenyl)-1-(3-hydroxy-2,2-dimethylpropyl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl]acetyl]amino]pentanoate

methyl 5-(4-dimethylaminobenzoyl)aminovalerate

Refernces

• 1、 Perrone, Maria Grazia,Vitale, Paola,Ferorelli, Savina,Boccarelli, Angelina,Coluccia, Mauro,Pannunzio, Alessandra,Campanella, Federica,Di Mauro, Giuseppe,Bonaccorso, Carmela,Fortuna, Cosimo G.,Scilimati, Antonio. "Effect of mofezolac-galactose distance in conjugates targeting cyclooxygenase (COX)-1 and CNS GLUT-1 carrier". . p. 404 - 416. Retrieved 2017.
• 2、 Cao, Sheng,Cao, Yuting,Hou, Min,Jiang, Qiuyan,Li, Xiaohe,Lin, Gang,Liu, Xiang,Liu, Xinhua,Lu, Cheng,Mao, Jiahe,Peng, Junya,Qi, Min,Qin, Shuanglin,Song, Yang,Wei, Yujiao,Xie, Maodun,Yang, Cheng,Yang, Guang,Yang, Yuyu,Zhou, Honggang,Zhou, Yunyun. "Design and synthesis of Leukotriene A4 hydrolase inhibitors to alleviate idiopathic pulmonary fibrosis and acute lung injury". supporting information. . Retrieved 2020/07/16.
• 3、 Fang, Wei-Shuo,Sun, De-yang,Yang, Shuang,Cheng, Chen,Moschke, Katrin,Li, Tianqi,Sun, Shanshan,Lichtenthaler, Stefan F.,Huang, Jian,Wang, Yinghong. "Discovery of a series of selective and cell permeable beta-secretase (BACE1) inhibitors by fragment linking with the assistance of STD-NMR". supporting information. . Retrieved 2019/09/30.