methacrylyl-CoA
TL;DR: methacrylyl-CoA (CAS 6008-91-9) is a chemical compound with molecular formula C25H40N7O17P3S and molecular weight 835.1414 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2-methylprop-2-enethioate
Also Known As: methacrylyl-CoA, methacrylyl-coenzyme A, Coenzyme A, methacrylyl, Methacrylyl-CoA (not stereospecified), 9h-purin-6-amine, 9-[5-o-[hydroxy[[hydroxy[3-hydroxy-2,2-dimethyl-4-[[3-[[2-[(2-methyl-1-oxo-2-propen-1-yl)thio]ethyl]amino]-3-oxopropyl]amino]-4-oxobutoxy]phosphinyl]oxy]phosphinyl]-3-o-phosphonopentofuranosyl]-
Technical Specifications
| Molecular Formula | C25H40N7O17P3S |
| Molecular Weight | 835.1414 g/mol |
| XLogP | -4.6 |
| Topological Polar Surface Area (TPSA) | 389.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 21 |
| Exact Mass | 835.1414 Da |
| Heavy Atoms | 53 |
| Complexity | 1480.0 |
| SMILES | CC(=C)C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O |
| InChIKey | NPALUEYCDZWBOV-UHFFFAOYSA-N |
Product Description
Applications: methacrylyl-CoA is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies methacrylyl-CoA (CAS 6008-91-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
methacrylyl-CoA is a fine chemical identified by CAS number 6008-91-9 and the molecular formula C25H40N7O17P3S and a molecular weight of 835.14 g/mol. It is also known as methacrylyl-CoA and methacrylyl-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 methacrylyl-CoA
Property Insights of methacrylyl-CoA
The XLogP value of -4.6 indicates that methacrylyl-CoA is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 389.0 Ų indicates high polarity, suggesting methacrylyl-CoA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, methacrylyl-CoA 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 methacrylyl-CoA?
The CAS number of methacrylyl-CoA is 6008-91-9.
What is the molecular formula of methacrylyl-CoA?
The molecular formula of methacrylyl-CoA is C25H40N7O17P3S.
What is the molecular weight of methacrylyl-CoA?
The molecular weight of methacrylyl-CoA is 835.1414 g/mol.
What are the applications of methacrylyl-CoA?
methacrylyl-CoA is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies methacrylyl-CoA (CAS 6008-91-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...
Where can I buy methacrylyl-CoA?
You can request a quote for methacrylyl-CoA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methacrylyl-CoA?
Yes, CoreyChem provides custom synthesis services for methacrylyl-CoA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.