Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate
TL;DR: Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate (CAS 18127-93-0) is a chemical compound with molecular formula C14H16O8 and molecular weight 312.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyloxy-2-(4-acetyloxy-2,6-dimethoxyphenyl)acetic acid
Also Known As: Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate, 4,alpha-Bis(acetyloxy)-2,6-dimethoxybenzeneacetic acid, 2-acetyloxy-2-(4-acetyloxy-2,6-dimethoxyphenyl)acetic acid, (Acetyloxy)[4-(acetyloxy)-2,6-dimethoxyphenyl]acetic acid, (Acetyloxy)[4-(acetyloxy)-2,6-dimethoxyphenyl]acetic acid #
| Molecular Formula | C14H16O8 |
|---|---|
| Molecular Weight | 312.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.0845 |
| Heavy Atoms | 22 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 18127-93-0 |
|---|---|
| SMILES | CC(=O)OC1=CC(=C(C(=C1)OC)C(C(=O)O)OC(=O)C)OC |
| InChIKey | UCQSDGRWZIHPGY-UHFFFAOYSA-N |
Product Overview
Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate (CAS 18127-93-0), with molecular formula C14H16O8 and molecular weight 312.08 g/mol. IUPAC: 2-acetyloxy-2-(4-acetyloxy-2,6-dimethoxyphenyl)acetic acid.
Chemical Property Profile of Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate
Property Insights of Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate. Following Lipinski's Rule of Five, Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate has 1 hydrogen bond donor(s) and 8 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 Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate?
The CAS number of Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate is 18127-93-0.
What is the molecular formula of Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate?
The molecular formula of Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate is C14H16O8.
What is the molecular weight of Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate?
The molecular weight of Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate is 312.08 g/mol.
Where can I buy Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate?
You can request a quote for Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate?
Yes, KEHONG BIO provides custom synthesis services for Mandelic acid, 4-hydroxy-2,6-dimethoxy-, diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.