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[3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate
TL;DR: [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate (CAS 71155-68-5) is a chemical compound with molecular formula C14H16O7 and molecular weight 296.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(diacetyloxymethyl)-2-methoxyphenyl] acetate
Also Known As: NCIOpen2_006026, KST-1A7791, [3-(acetyloxy)-4-methoxyphenyl]methanediyl diacetate, 3-Acetyloxy-4-methoxybenzylidenediacetate, [5-(diacetyloxymethyl)-2-methoxyphenyl] acetate
| Molecular Formula | C14H16O7 |
|---|---|
| Molecular Weight | 296.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 296.0896 |
| Heavy Atoms | 21 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 71155-68-5 |
|---|---|
| SMILES | CC(=O)OC1=C(C=CC(=C1)C(OC(=O)C)OC(=O)C)OC |
| InChIKey | NKTWGBVMIBQCSI-UHFFFAOYSA-N |
Product Overview
[3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate (CAS 71155-68-5), with molecular formula C14H16O7 and molecular weight 296.09 g/mol. IUPAC: [5-(diacetyloxymethyl)-2-methoxyphenyl] acetate.
Chemical Property Profile of [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate
Property Insights of [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate. Following Lipinski's Rule of Five, [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate has 0 hydrogen bond donor(s) and 7 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 [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate?
The CAS number of [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate is 71155-68-5.
What is the molecular formula of [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate?
The molecular formula of [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate is C14H16O7.
What is the molecular weight of [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate?
The molecular weight of [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate is 296.09 g/mol.
Where can I buy [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate?
You can request a quote for [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for [3-(Acetyloxy)-4-methoxyphenyl]methanediyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.