Hydroxy-PEG1-t-butyl ester - ≥97% , CAS No.671802-00-9

CAS: 671802-00-9 Cat. No.: H336182 분자식: C₉H₁₈O₄ 분자량: 190.24 EC 번호: 817-979-2

GRADE & PURITY ≥97%

Synonyms

HO-PEG1-CH2CH2COOtBu | SCHEMBL898476 | Tert-butyl 3-(2-hydroxyethoxy)propanoate | AS-18988 | BP-20597 | WBB80200 | A915812 | AMY37947 | FT-0715716 | HO-PEG1-t-butyl ester | Hydroxy-PEG1-t-butyl ester | MFCD22056310 | Tert-butyl3-(2-hydroxyethoxy)propanoat

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

개요

Hydroxy-PEG1-(CH2)2-Boc is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs.
Application：
Applicated in medical research, drug-release, nanotechnology and new materials research, cell culture. In the study of ligand, polypeptide synthesis support, a graft polymer compounds, new materials, and polyethylene glycol-modified functional coatings and other aspects of the active compound.

Specifications

동의어

HO-PEG1-CH2CH2COOtBu | SCHEMBL898476 | Tert-butyl 3-(2-hydroxyethoxy)propanoate | AS-18988 | BP-20597 | WBB80200 | A915812 | AMY37947 | FT-0715716 | HO-PEG1-t-butyl ester | Hydroxy-PEG1-t-butyl ester | MFCD22056310 | Tert-butyl3-(2-hydroxyethoxy)propanoat

사양 및 순도

≥97%

보관 조건

Store at 2-8°C,Protected from light

배송

Wet ice

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순수함

≥97%

이름과 식별자

• Pubchem Sid: 528774712
• 정식 스마일: CC(C)(C)OC(=O)CCOCCO
• IUPAC Name: tert-butyl 3-(2-hydroxyethoxy)propanoate
• InChIKey: ACWLDITVZGWIKA-UHFFFAOYSA-N
• INCHI: 1S/C9H18O4/c1-9(2,3)13-8(11)4-6-12-7-5-10/h10H,4-7H2,1-3H3
• 이성체 SMILES: CC(C)(C)OC(=O)CCOCCO
• 분자량: 190.24
• Reaxy-Rn: 9759497
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9759497&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 분류 Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 분류: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acid esters
• Alternative Parents: Monocarboxylic acids and derivatives Dialkyl ethers Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

관련 대상(비인간)

Pseudomonas aeruginosa (123386 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

작용 메커니즘

화학 및 물리적 특성

• 감도: Light sensitive
• 분자량: 190.240 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 190.121 Da
• Monoisotopic Mass: 190.121 Da
• Topological Polar Surface Area: 55.800 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 148.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1