phenyl acetyl Coa
TL;DR: phenyl acetyl Coa (CAS 69113-63-9) is a chemical compound with molecular formula C29H42LiN7O17P3S and molecular weight 892.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: phenyl acetyl Coa, phenylacetylCoa, Phenylacetyl coenzyme A lithium salt, Phenylacetyl CoA-lithium, Phenylacetyl-CoA Li salt
| Molecular Formula | C29H42LiN7O17P3S |
|---|---|
| Molecular Weight | 892.17 g/mol |
| LogP | -0.4734 |
| Topological Polar Surface Area | 363.63 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 21 |
| Exact Mass | 892.1731 |
| Heavy Atoms | 58 |
| Complexity | 2030.1821 |
Chemical Identifiers
| CAS Number | 69113-63-9 |
|---|---|
| SMILES | [Li].CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CC4=CC=CC=C4)O |
Product Overview
phenyl acetyl Coa (CAS 69113-63-9), with molecular formula C29H42LiN7O17P3S and molecular weight 892.17 g/mol.
Chemical Property Profile of phenyl acetyl Coa
Property Insights of phenyl acetyl Coa
The XLogP value of -0.4734 indicates that phenyl acetyl Coa is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 363.63 Ų indicates high polarity, suggesting phenyl acetyl Coa may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, phenyl acetyl Coa has 9 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of phenyl acetyl Coa?
The CAS number of phenyl acetyl Coa is 69113-63-9.
What is the molecular formula of phenyl acetyl Coa?
The molecular formula of phenyl acetyl Coa is C29H42LiN7O17P3S.
What is the molecular weight of phenyl acetyl Coa?
The molecular weight of phenyl acetyl Coa is 892.17 g/mol.
Where can I buy phenyl acetyl Coa?
You can request a quote for phenyl acetyl Coa directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for phenyl acetyl Coa?
Yes, KEHONG BIO provides custom synthesis services for phenyl acetyl Coa and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.