3-Amino-3-iminopropanoic acid ethyl ester hydrochloride
- Product Name
- 3-Amino-3-iminopropanoic acid ethyl ester hydrochloride
- CAS No.
- 57508-48-2
- Chemical Name
- 3-Amino-3-iminopropanoic acid ethyl ester hydrochloride
- Synonyms
- ETHYL AMIDINOACETATE HCL;2-Amidinoacetate HydrochL;Ethyl amidinoacetate hydrochloride;carbethoxyacetamidine hydrochloride;Ethyl 2-Amidinoacetate Hydrochloride;ethyl 2-carbaMiMidoylacetate hydrochloride;Ethyl 3-aMino-3-iMinopropanate hydrochloride;Ethyl3-amino-3-iminopropanoate hydrochloride;3-AMINO-3-IMINO-PROPANOIC ACID, ETHYL ESTER HCL;1-amino-3-ethoxy-3-oxopropan-1-iminium chloride
- CBNumber
- CB3368769
- Molecular Formula
- C5H11ClN2O2
- Formula Weight
- 166.61
- MOL File
- 57508-48-2.mol
3-Amino-3-iminopropanoic acid ethyl ester hydrochloride Property
- Melting point:
- 105-108℃
- storage temp.
- Inert atmosphere,Room Temperature
- form
- Solid
- Appearance
- White to light yellow Solid
- InChI
- InChI=1S/C5H10N2O2.ClH/c1-2-9-5(8)3-4(6)7;/h2-3H2,1H3,(H3,6,7);1H
- InChIKey
- VOHFLYOSVGWQOS-UHFFFAOYSA-N
- SMILES
- C(C(OCC)=O)C(N)=N.Cl
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405Store locked up.
N-Bromosuccinimide Price
- Product number
- A609918
- Product name
- 3-Amino-3-imino-propanoicacid,ethylesterhydrochloride
- Packaging
- 100mg
- Price
- $45
- Updated
- 2021/12/16
- Product number
- A609918
- Product name
- 3-Amino-3-imino-propanoicacid,ethylesterhydrochloride
- Packaging
- 250mg
- Price
- $55
- Updated
- 2021/12/16
- Product number
- A609918
- Product name
- 3-Amino-3-imino-propanoicacid,ethylesterhydrochloride
- Packaging
- 500mg
- Price
- $65
- Updated
- 2021/12/16
- Product number
- 020077
- Product name
- Carbamimidoyl-acetic acid ethyl ester hydrochloride
- Packaging
- 1g
- Price
- $12
- Updated
- 2021/12/16
- Product number
- 020077
- Product name
- Carbamimidoyl-acetic acid ethyl ester hydrochloride
- Packaging
- 5g
- Price
- $57
- Updated
- 2021/12/16
3-Amino-3-iminopropanoic acid ethyl ester hydrochloride Chemical Properties,Usage,Production
Uses
It is used as a pharmaceutical intermediate.
Synthesis
27317-59-5
57508-48-2
The general procedure for the synthesis of ethyl 3-amidinopropionate hydrochloride from ethyl 3-ethoxy-3-iminopropionate was as follows: ethyl 3-amino-3-ethoxyacrylate (760 mg, 4.78 mmol) and ammonium chloride (270 mg, 5.0 mmol) were dissolved in ethanol (4.0 mL) in a glass tube rated for 10 mL pressure. The reaction was carried out using a CEM Discover microwave synthesizer at an initial magnetron power of 200 W for 1 h at 120°C (hold time). Upon completion of the reaction, the reaction mixture was cooled in a stream of compressed air and subsequently filtered. The filtrate was concentrated by vacuum evaporation and the residue was ground with diethyl ether to afford ethyl 3-amidinopropionate hydrochloride (923 mg, 78% yield) as a colorless solid, which was ready for use without further purification. The product characterization data were as follows: νmax (neat)/ cm-1 3300, 3095, 1738, 1687; δH (500 MHz; d6-DMSO)/ ppm 9.16 (2H, broad single peak, NH2), 8.88 (2H, broad single peak, NH2), 4.15 (2H, quartet peak, J = 7.1 Hz, OCH2), 3.63 (2H, single peak, CH2), 1.22 (3H, triple peak, J = 7.1 Hz, CH3); δC (125 MHz, d6-DMSO)/ ppm 166.7 (C=O), 163.6 (C=N), 61.9 (OCH2), 38.2 (CH2), 14.4 (CH3); m/z (EI) 130 (M-+).
References
[1] Synlett, 2016, vol. 27, # 11, p. 1728 - 1732
[2] Chemical and Pharmaceutical Bulletin, 1995, vol. 43, # 5, p. 788 - 796
[3] Patent: WO2008/33745, 2008, A2. Location in patent: Page/Page column 70
[4] Patent: WO2008/33747, 2008, A2. Location in patent: Page/Page column 254-255
[5] European Journal of Medicinal Chemistry, 2011, vol. 46, # 12, p. 6002 - 6014
3-Amino-3-iminopropanoic acid ethyl ester hydrochloride Preparation Products And Raw materials
Raw materials
Preparation Products
3-Amino-3-iminopropanoic acid ethyl ester hydrochloride Suppliers
- Tel
- 17661365138
- 2845578351@qq.com
- Country
- China
- ProdList
- 7115
- Advantage
- 58
- Tel
- 021-50795510 4000665055
- sy-c5@accelachem.com
- Country
- China
- ProdList
- 10000
- Advantage
- 58
- Tel
- 021-021-58432009 400-005-6266
- Fax
- 021-58436166
- sales8178@energy-chemical.com
- Country
- China
- ProdList
- 44801
- Advantage
- 61
- Tel
- 13817811078
- Fax
- 86-021-50426522,50426273
- sales@jingyan-chemical.com
- Country
- China
- ProdList
- 9976
- Advantage
- 60
- Tel
- +86-21-68182121
- Fax
- +86-21-68182121
- Country
- China
- ProdList
- 882
- Advantage
- 52
- Tel
- 025-83697070
- Fax
- +86-25-83453306
- info@chemlin.com.cn
- Country
- China
- ProdList
- 15883
- Advantage
- 64
- Tel
- 4009903999 13355009207
- Fax
- 0539-6365991
- 3007715519@qq.com
- Country
- China
- ProdList
- 18729
- Advantage
- 57
- Tel
- 021-20958197 20965099
- Fax
- 021-20960837
- sales@skychemical.com
- Country
- China
- ProdList
- 1183
- Advantage
- 57
- Tel
- 18270980682
- Fax
- 021 51613951
- mlcheng@sunwaypharm.cn
- Country
- China
- ProdList
- 8669
- Advantage
- 57
- Tel
- +86 (21) 5196-9732
- Fax
- +86 (21) 5196-9733
- Country
- China
- ProdList
- 996
- Advantage
- 57
View Lastest Price from 3-Amino-3-iminopropanoic acid ethyl ester hydrochloride manufacturers
- Product
- 3-Amino-3-iminopropanoic acid ethyl ester hydrochloride 57508-48-2
- Price
- US $0.00/kg
- Min. Order
- 1kg
- Purity
- 98%
- Supply Ability
- 1000kg
- Release date
- 2025-07-10
- Product
- 3-Amino-3-iminopropanoic acid ethyl ester hydrochloride 57508-48-2
- Price
- US $1.00/ASSAYS
- Min. Order
- 1ASSAYS
- Purity
- 85.0-99.8%
- Supply Ability
- 20tons
- Release date
- 2020-01-08