[(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate
TL;DR: [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate (CAS 6961-70-2) is a chemical compound with molecular formula C15H18O6 and molecular weight 294.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-acetyloxyphenyl)-propanoyloxymethyl] propanoate
Also Known As: KST-1A7637, [4-(acetyloxy)phenyl]methanediyl dipropanoate, [(4-acetyloxyphenyl)-propanoyloxymethyl] propanoate, 1-iodo-2,5-dimethoxy-4-nitro-benzene, [4-(Acetyloxy)phenyl]methylene dipropanoate
| Molecular Formula | C15H18O6 |
|---|---|
| Molecular Weight | 294.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 294.11035 |
| Heavy Atoms | 21 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 6961-70-2 |
|---|---|
| SMILES | CCC(=O)OC(C1=CC=C(C=C1)OC(=O)C)OC(=O)CC |
| InChIKey | YNKPHSNUGLRPRD-UHFFFAOYSA-N |
Product Overview
[(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate (CAS 6961-70-2), with molecular formula C15H18O6 and molecular weight 294.11 g/mol. IUPAC: [(4-acetyloxyphenyl)-propanoyloxymethyl] propanoate.
Chemical Property Profile of [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate
Property Insights of [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate. Following Lipinski's Rule of Five, [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate?
The CAS number of [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate is 6961-70-2.
What is the molecular formula of [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate?
The molecular formula of [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate is C15H18O6.
What is the molecular weight of [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate?
The molecular weight of [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate is 294.11 g/mol.
Where can I buy [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate?
You can request a quote for [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate?
Yes, KEHONG BIO provides custom synthesis services for [(4-Acetyloxyphenyl)-propanoyloxymethyl] propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.