dec-2-ynoyl-coenzyme A
TL;DR: dec-2-ynoyl-coenzyme A (CAS 105528-05-0) is a chemical compound with molecular formula C31H50N7O17P3S and molecular weight 917.21967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] dec-2-ynethioate
Also Known As: 2-Decynoyl-coa, Dec-2-ynoyl-coenzyme A, Coenzyme A, dec-2-ynoyl-, Coenzyme A, S-2-decynoate, 2-Decynoyl-CoA; (Acyl-CoA); [M+H]+;
Technical Specifications
| Molecular Formula | C31H50N7O17P3S |
| Molecular Weight | 917.21967 g/mol |
| XLogP | -1.5 |
| Topological Polar Surface Area (TPSA) | 389.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 25 |
| Exact Mass | 917.21967 Da |
| Heavy Atoms | 59 |
| Complexity | 1630.0 |
| SMILES | CCCCCCCC#CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O |
| InChIKey | CEGGBBHEUBHATI-HSJNEKGZSA-N |
Product Description
Applications: dec-2-ynoyl-coenzyme A is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
dec-2-ynoyl-coenzyme A is a fine chemical identified by CAS number 105528-05-0 and the molecular formula C31H50N7O17P3S and a molecular weight of 917.22 g/mol. Synonyms include 2-Decynoyl-coa and Dec-2-ynoyl-coenzyme A.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of dec-2-ynoyl-coenzyme A
Property Insights of dec-2-ynoyl-coenzyme A
The XLogP value of -1.5 indicates that dec-2-ynoyl-coenzyme A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 389.0 Ų indicates high polarity, suggesting dec-2-ynoyl-coenzyme A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, dec-2-ynoyl-coenzyme A has 9 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of dec-2-ynoyl-coenzyme A?
The CAS number of dec-2-ynoyl-coenzyme A is 105528-05-0.
What is the molecular formula of dec-2-ynoyl-coenzyme A?
The molecular formula of dec-2-ynoyl-coenzyme A is C31H50N7O17P3S.
What is the molecular weight of dec-2-ynoyl-coenzyme A?
The molecular weight of dec-2-ynoyl-coenzyme A is 917.21967 g/mol.
What are the applications of dec-2-ynoyl-coenzyme A?
dec-2-ynoyl-coenzyme A is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy dec-2-ynoyl-coenzyme A?
You can request a quote for dec-2-ynoyl-coenzyme A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for dec-2-ynoyl-coenzyme A?
Yes, CoreyChem provides custom synthesis services for dec-2-ynoyl-coenzyme A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.