Vanillyl alcohol diacetate
TL;DR: Vanillyl alcohol diacetate (CAS 17574-14-0) is a chemical compound with molecular formula C12H14O5 and molecular weight 238.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetyloxy-3-methoxyphenyl)methyl acetate
Also Known As: Vanillyl alcohol diacetate, (4-acetyloxy-3-methoxyphenyl)methyl acetate, 4-(acetyloxy)-3-methoxybenzyl acetate, 4-acetoxymethyl-2-methoxyphenyl acetate, [4-(acetyloxy)-3-methoxyphenyl]methyl acetate
| Molecular Formula | C12H14O5 |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 1.6836 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.08412 |
| Heavy Atoms | 17 |
| Complexity | 424.9042 |
Chemical Identifiers
| CAS Number | 17574-14-0 |
|---|---|
| SMILES | CC(=O)OCC1=CC(=C(C=C1)OC(=O)C)OC |
Product Overview
Vanillyl alcohol diacetate (CAS 17574-14-0), with molecular formula C12H14O5 and molecular weight 238.08 g/mol. IUPAC: (4-acetyloxy-3-methoxyphenyl)methyl acetate.
Chemical Property Profile of Vanillyl alcohol diacetate
Property Insights of Vanillyl alcohol diacetate
The XLogP value of 1.6836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vanillyl alcohol diacetate. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Vanillyl alcohol diacetate. Following Lipinski's Rule of Five, Vanillyl alcohol diacetate has 0 hydrogen bond donor(s) and 5 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 Vanillyl alcohol diacetate?
The CAS number of Vanillyl alcohol diacetate is 17574-14-0.
What is the molecular formula of Vanillyl alcohol diacetate?
The molecular formula of Vanillyl alcohol diacetate is C12H14O5.
What is the molecular weight of Vanillyl alcohol diacetate?
The molecular weight of Vanillyl alcohol diacetate is 238.08 g/mol.
Where can I buy Vanillyl alcohol diacetate?
You can request a quote for Vanillyl alcohol diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vanillyl alcohol diacetate?
Yes, KEHONG BIO provides custom synthesis services for Vanillyl alcohol diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.