Ethyl 4-aminobutyrate hydrochloride

Base Information

• Chemical Name: Ethyl 4-aminobutyrate hydrochloride
• CAS No.: 6937-16-2
• Molecular Formula: C6H13NO2^.HCl
• Molecular Weight: 167.636
• Hs Code.: 29224999
• European Community (EC) Number: 230-063-1
• ChEMBL ID: CHEMBL2004022
• DSSTox Substance ID: DTXSID00989144
• NSC Number: 40245
• Mol file: 6937-16-2.mol

Synonyms:6937-16-2;Ethyl 4-aminobutyrate hydrochloride;ethyl 4-aminobutanoate hydrochloride;Ethyl 4-Aminobutyrate HCl;4-Aminobutyric acid ethyl ester hydrochloride;MFCD00012915;ethyl 4-aminobutanoate HCl;Butanoic acid, 4-amino-, ethyl ester, hydrochloride;4-aminobutanoic acid ethyl ester hydrochloride;DF 503;gamma-Aminobutyric acid ethyl ester hydrochloride;NSC40245;H-GABA-OEt.HCl;WLN: Z3VO2 &GH;SCHEMBL572907;CHEMBL2004022;Ethyl4-aminobutyratehydrochloride;DTXSID00989144;CXVQSUBJMYZELD-UHFFFAOYSA-N;Ethyl ?-aminobutyrate hydrochloride;ethyl-4-aminobutyrate hydrochloride;ethyl 4-aminobutanoate-hydrochloride;ethyl 4-aminobutanoate;hydrochloride;ethyl 4-amino-butyrate hydrochloride;AKOS007930360;CS-W010794;GS-6884;Butyric acid, ethyl ester, hydrochloride;Ethyl .gamma.-aminobutyrate hydrochloride;Ethyl.gamma.-aminobutyrate, hydrochloride;AM808169;BP-10254;Butanoic acid, ethyl ester, hydrochloride;Ethyl 4-aminobutyrate hydrochloride, 98%;SY015028;4-Amino-butyric acid ethyl ester HCl salt;E0924;FT-0625763;NS00044317;4-amino-butyric acid ethyl ester hydrochloride;EN300-20544;4-aminobutanoic acid, ethyl ester, hydrochloride;H-GABA-OEt inverted exclamation mark currencyHCl;A836457;Ethyl 4-aminobutanoate--hydrogen chloride (1/1)

Chemical Property of Ethyl 4-aminobutyrate hydrochloride

Chemical Property:

• Appearance/Colour: WHITE SOLID, POWDER OR CRYSTALS
• Vapor Pressure: 0.826mmHg at 25°C
• Melting Point: 89-91 °C(lit.)
• Refractive Index: 1.434
• Boiling Point: 182.1 °C at 760 mmHg
• Flash Point: 54.5 °C
• PSA: 52.32000
• Density: 0.973g/cm³
• LogP: 1.79070
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Sensitive.: Hygroscopic
• Solubility.: soluble in Methanol
• 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

Ethyl 4-Aminobutyrate Hydrochloride >98.0%(N)(T) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCOC(=O)CCCN.Cl

Technology Process of Ethyl 4-aminobutyrate hydrochloride

There total 5 articles about Ethyl 4-aminobutyrate 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: 98.0%

ethyl 4-<(tert-butoxycarbonyl)amino>butanoate (228110-66-5) → ethyl γ-aminobutyrate hydrochloride (6937-16-2)

Guidance literature:

With hydrogenchloride; In ethyl acetate; for 3.5h;

DOI:10.1016/j.ejmech.2010.11.003

Reference yield: 97.0%

ethanol (64-17-5) + 4-amino-n-butyric acid (56-12-2) → ethyl γ-aminobutyrate hydrochloride (6937-16-2)

Guidance literature:

With thionyl chloride; at 0 - 20 ℃; for 12.5h;

Reference yield: 88.0%

5-ethoxy-2H 3,4-dihydropyrrolium hydrochloride (90670-73-8) → ethyl γ-aminobutyrate hydrochloride (6937-16-2)

Guidance literature:

With water; for 10h; Ambient temperature;

upstream raw materials:

ethanol

4-amino-n-butyric acid

5-ethoxy-2H 3,4-dihydropyrrolium hydrochloride

5-ethoxy-3,4-dihydro-2H-pyrrole

Downstream raw materials:

E-4ib

C₁₅H₂₀N₂O₅S

4-<3-(3-Ethoxy-acryloyl)ureido>-buttersaeure-ethylester

N-L-Glutaminyl-γ-aminobuttersaeureethylester