Acid-PEG3-t-butyl ester - ≥95% , CAS No.1807539-06-5

CAS: 1807539-06-5 Cat. No.: A596989 Molecular Weight: 306.4 PubChem CID: 77078220
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
Acid-PEG3-C2-Boc | Carboxy-PEG3-t-butyl ester | 2,2-Dimethyl-4-oxo-3,7,10,13-tetraoxahexadecan-16-oic acid
Storage
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
Application
227,228,229
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100mg
A596989-100mg
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500mg
A596989-500mg
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1g
A596989-1g
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -20°C,Argon charged Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Acid-PEG3-t-butyl ester is a PEG derivative containing a t-butyl protected carboxyl group with a terminal carboxylic acid. The terminal carboxylic acid can be reacted with primary amine groups in the presence of activators (e.g. EDC, or DCC) to form a stable amide bond. The hydrophilic PEG spacer increases solubility in aqueous media. The t-butyl protected carboxyl group can be deprotected under acidic conditions.Acid-PEG3-C2-Boc is a PEG- and Alkyl/ether-based PROTAC linker can be used in the synthesis of PROTACs for the degradation of EGFR and inhibition of mTOR.

Specifications

Synonyms
Acid-PEG3-C2-Boc | Carboxy-PEG3-t-butyl ester | 2, 2-Dimethyl-4-oxo-3, 7, 10, 13-tetraoxahexadecan-16-oic acid
Specifications & Purity
≥95%
Storage
Store at -20°C, Argon charged
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%
Names and Identifiers
Canonical SmilesCC(C)(C)OC(=O)CCOCCOCCOCCC(=O)O
IUPAC Name3-[2-[2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropoxy]ethoxy]ethoxy]propanoic acid
InChIKeyVDWZJPCGUNJFEE-UHFFFAOYSA-N
INCHI1S/C14H26O7/c1-14(2,3)21-13(17)5-7-19-9-11-20-10-8-18-6-4-12(15)16/h4-11H2,1-3H3,(H,15,16)
Isomeric SMILES CC(C)(C)OC(=O)CCOCCOCCOCCC(=O)O
PubChem CID 77078220
Molecular Weight 306.4

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
SubclassDicarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentDicarboxylic acids and derivatives
Alternative Parents Carboxylic acid esters  Dialkyl ethers  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Dicarboxylic acid or derivatives - Carboxylic acid ester - Ether - Dialkyl ether - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

7 results found

Lot NumberCertificate TypeDateItem
F2523122Certificate of AnalysisDec 11, 2024 A596989
F2523128Certificate of AnalysisDec 11, 2024 A596989
F2523130Certificate of AnalysisDec 11, 2024 A596989
F2523131Certificate of AnalysisDec 11, 2024 A596989
F2523132Certificate of AnalysisDec 11, 2024 A596989
F2523137Certificate of AnalysisDec 11, 2024 A596989
G2508729Certificate of AnalysisDec 11, 2024 A596989
Chemical and Physical Properties
SolubilitySolubility in Water, DMSO, DCM, DMF
Molecular Weight306.350 g/mol
XLogP30.100
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count14
Exact Mass306.168 Da
Monoisotopic Mass306.168 Da
Topological Polar Surface Area91.300 Ų
Heavy Atom Count21
Formal Charge0
Complexity296.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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