5'-Adenylic acid, anhydride with acetic acid (1:1)
TL;DR: 5'-Adenylic acid, anhydride with acetic acid (1:1) (CAS 13015-87-7) is a chemical compound with molecular formula C12H16N5O8P and molecular weight 389.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] acetate
Also Known As: Acetyl adenylate, Acetyladenylate, Acetyl amp, 5'-Acetylphosphoadenosine, 5 -Adenylic acid acetyl ester
| Molecular Formula | C12H16N5O8P |
|---|---|
| Molecular Weight | 389.07 g/mol |
| LogP | -2.9 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 389.07364 |
| Heavy Atoms | 26 |
| Complexity | 584.0 |
Chemical Identifiers
| CAS Number | 13015-87-7 |
|---|---|
| SMILES | CC(=O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O |
| InChIKey | UBPVOHPZRZIJHM-WOUKDFQISA-N |
Product Overview
5'-Adenylic acid, anhydride with acetic acid (1:1) (CAS 13015-87-7), with molecular formula C12H16N5O8P and molecular weight 389.07 g/mol. IUPAC: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] acetate.
Chemical Property Profile of 5'-Adenylic acid, anhydride with acetic acid (1:1)
Property Insights of 5'-Adenylic acid, anhydride with acetic acid (1:1)
The XLogP value of -2.9 indicates that 5'-Adenylic acid, anhydride with acetic acid (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 192.0 Ų indicates high polarity, suggesting 5'-Adenylic acid, anhydride with acetic acid (1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'-Adenylic acid, anhydride with acetic acid (1:1) has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5'-Adenylic acid, anhydride with acetic acid (1:1)?
The CAS number of 5'-Adenylic acid, anhydride with acetic acid (1:1) is 13015-87-7.
What is the molecular formula of 5'-Adenylic acid, anhydride with acetic acid (1:1)?
The molecular formula of 5'-Adenylic acid, anhydride with acetic acid (1:1) is C12H16N5O8P.
What is the molecular weight of 5'-Adenylic acid, anhydride with acetic acid (1:1)?
The molecular weight of 5'-Adenylic acid, anhydride with acetic acid (1:1) is 389.07 g/mol.
Where can I buy 5'-Adenylic acid, anhydride with acetic acid (1:1)?
You can request a quote for 5'-Adenylic acid, anhydride with acetic acid (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-Adenylic acid, anhydride with acetic acid (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 5'-Adenylic acid, anhydride with acetic acid (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.