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Small Molecules & Compound Libraries
Ligand families
PROTACs, molecular glues and other degraders
2,5,8,11,14,17,20,23-Octoxapentacosane-25-thiol - 95%, high purity , CAS No.651042-83-0
2,5,8,11,14,17,20,23-Octoxapentacosane-25-thiol - 95%, high purity , CAS No.651042-83-0
Basic Description
Synonyms
2,5,8,11,14,17,20,23-OCTAOXAPENTACOSANE-25-THIOL | MFCD16619328 | HY-141330 | BP-21118 | AKOS027320786 | AS-67723 | C70280 | CS-0115111 | 2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanethiol | SCHEMBL17731980 | m-PEG8
Specifications & Purity
≥95%
Storage Temp
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Ethers
Intermediate Tree Nodes
Not available
Direct Parent
Dialkyl ethers
Alternative Parents
Alkylthiols Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Dialkyl ether - Alkylthiol - Hydrocarbon derivative - Organosulfur compound - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
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.
Names and Identifiers
IUPAC Name
2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanethiol
INCHI
InChI=1S/C17H36O8S/c1-18-2-3-19-4-5-20-6-7-21-8-9-22-10-11-23-12-13-24-14-15-25-16-17-26/h26H,2-17H2,1H3
InChIKey
LWTPDVASPXFETP-UHFFFAOYSA-N
Smiles
COCCOCCOCCOCCOCCOCCOCCOCCS
Isomeric SMILES
COCCOCCOCCOCCOCCOCCOCCOCCS
Molecular Weight
400.53
Reaxy-Rn
43188234
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=43188234&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
400.500 g/mol
XLogP3
-0.700
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
9
Rotatable Bond Count
23
Exact Mass
400.213 Da
Monoisotopic Mass
400.213 Da
Topological Polar Surface Area
74.800 Ų
Heavy Atom Count
26
Formal Charge
0
Complexity
249.000
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
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