2,2-DIMETHYL-4-OXO-3,8,11,14-TETRAOXA-5-AZAHEXADECAN-16-OIC ACID
- Product Name
- 2,2-DIMETHYL-4-OXO-3,8,11,14-TETRAOXA-5-AZAHEXADECAN-16-OIC ACID
- CAS No.
- 462100-06-7
- Chemical Name
- 2,2-DIMETHYL-4-OXO-3,8,11,14-TETRAOXA-5-AZAHEXADECAN-16-OIC ACID
- Synonyms
- Boc-PEG3- CH2COOH;NHBoc-PEG3-CH2COOH;BocNH-PEG3-CH2COOH;Boc-N-amido-PEG3-CH2CO2H;t-boc-N-amido-PEG3-acetic acid;t-Boc-N-amido-PEG3-CH2CO2H >=95%;Boc-PEG3-CH2COOH [452100-06-7];Boc-11-amino-3,6,9-trioxaundecanoic acid;2-[2-[2-[2-(Boc-amino)ethoxy]ethoxy]ethoxy]acetic Acid;2,2-Dimethyl-4-oxo-3,8,11,14-tetraoxa-5-azahexadecan-16-
- CBNumber
- CB13059752
- Molecular Formula
- C13H25NO7
- Formula Weight
- 307.34
- MOL File
- 462100-06-7.mol
2,2-DIMETHYL-4-OXO-3,8,11,14-TETRAOXA-5-AZAHEXADECAN-16-OIC ACID Property
- Boiling point:
- 460.1±35.0 °C(Predicted)
- Density
- 1.141±0.06 g/cm3(Predicted)
- storage temp.
- -20°C
- solubility
- DMF: 5 mg/ml,DMSO: 1 mg/ml,Ethanol: 30 mg/ml
- form
- A neat oil
- pka
- 3.39±0.10(Predicted)
- color
- Colorless to light yellow
- InChI
- InChI=1S/C13H25NO7/c1-13(2,3)21-12(17)14-4-5-18-6-7-19-8-9-20-10-11(15)16/h4-10H2,1-3H3,(H,14,17)(H,15,16)
- InChIKey
- IFSMYFLQPDFUOI-UHFFFAOYSA-N
- SMILES
- C(OC(C)(C)C)(=O)NCCOCCOCCOCC(O)=O
- CAS DataBase Reference
- 462100-06-7
Safety
- HS Code
- 2924190090
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- 901575
- Product name
- t-Boc-N-amido-PEG3-CH2CO2H
- Purity
- ≥95%
- Packaging
- 50MG
- Price
- $65.87
- Updated
- 2025/07/31
- Product number
- 30536
- Product name
- Boc-NH-PEG3-CH2COOH
- Packaging
- 50mg
- Price
- $65
- Updated
- 2024/03/01
- Product number
- 30536
- Product name
- Boc-NH-PEG3-CH2COOH
- Packaging
- 100mg
- Price
- $121
- Updated
- 2024/03/01
- Product number
- 30536
- Product name
- Boc-NH-PEG3-CH2COOH
- Packaging
- 25mg
- Price
- $37
- Updated
- 2024/03/01
- Product number
- 30536
- Product name
- Boc-NH-PEG3-CH2COOH
- Packaging
- 250mg
- Price
- $283
- Updated
- 2024/03/01
2,2-DIMETHYL-4-OXO-3,8,11,14-TETRAOXA-5-AZAHEXADECAN-16-OIC ACID Chemical Properties,Usage,Production
Description
t-Boc-N-amido-PEG3-CH2CO2H is a PEG linker containing a terminal carboxylic acid and Boc-protected amino group. The hydrophilic PEG spacer increases solubility in aqueous media. The terminal carboxylic acid can react with primary amine groups in the presence of activators (e.g. EDC, or HATU) to form a stable amide bond. The Boc group can be deprotected under mild acidic conditions to form the free amine.
Uses
This is a crosslinker with a t-Boc protected amine on one end and a carboxyl group on the other end. The compound contains three PEG units to help improve solubility.
reaction suitability
reagent type: linker
Synthesis
79-08-3
139115-92-7
462100-06-7
To a 1000 mL three-neck flask was added 34.8 g of tert-butyl (2-(2-(2-hydroxyethoxy)ethoxy)ethyl)carbamate (1.0 eq.), 150 mL of toluene, and 150 mL of THF, 58.2 g of bromoacetic acid (3 eq.), and stirred to mix. The reaction mixture was heated to 45?50°C followed by the slow addition of 33.5 g of sodium hydroxide (6 eq.). The reaction was continued at room temperature overnight. The progress of the reaction was monitored by TLC. After completion of the reaction, the solvent was removed by evaporation. The residue was separated by extraction with water and ethyl acetate. The aqueous phase was adjusted to pH 3 with hydrochloric acid and subsequently extracted with dichloromethane. The dichloromethane layers were combined, dried over anhydrous sodium sulfate, filtered and concentrated to give 18 g of 5,8,11-trioxa-2-azatridecanedioic acid 1-tert-butyl ester (BP103a05) as an oil.
IC 50
PEGs; Alkyl/ether
References
[1] Inorganica Chimica Acta, 2011, vol. 365, # 1, p. 38 - 48
[2] Patent: EP3321279, 2018, A1. Location in patent: Paragraph 0066
2,2-DIMETHYL-4-OXO-3,8,11,14-TETRAOXA-5-AZAHEXADECAN-16-OIC ACID Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 2,2-DIMETHYL-4-OXO-3,8,11,14-TETRAOXA-5-AZAHEXADECAN-16-OIC ACID manufacturers
- Product
- BocNH-PEG3-CH2COOH 462100-06-7
- Price
- US $23.28/g
- Min. Order
- 10g
- Purity
- 98%
- Supply Ability
- 300kg
- Release date
- 2025-11-20
- Product
- 2,2-dimethyl-4-oxo-3,8,11,14-tetraoxa-5-azahexadecan-16-oic acid 462100-06-7
- Price
- US $0.00-0.00/g
- Min. Order
- 1g
- Purity
- 98%
- Supply Ability
- 1g/bottle, 10g/bottle, 100g/bottle
- Release date
- 2025-09-12
- Product
- Boc-NH-PEG3-CH2COOH 462100-06-7
- Price
- US $2.00-6.00/kg
- Min. Order
- 1kg
- Purity
- 99%
- Supply Ability
- 100kg
- Release date
- 2025-08-06