Vanillal S 10026
TL;DR: Vanillal S 10026 (CAS 123618-04-2) is a chemical compound with molecular formula C16H18O4 and molecular weight 274.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxy-4-hydroxybenzaldehyde;phenylmethanol
Also Known As: Vanillal S 10026, Vanillal S-10026, 3-ethoxy-4-hydroxybenzaldehyde; phenylmethanol, Benzaldehyde, 3-ethoxy-4-hydroxy-, mixt. with benzenemethanol, 3-ETHOXY-4-HYDROXY-BENZALDEHYDE; PHENYLMETHANOL
| Molecular Formula | C16H18O4 |
|---|---|
| Molecular Weight | 274.12 g/mol |
| LogP | 2.7823 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.1205 |
| Heavy Atoms | 20 |
| Complexity | 523.255 |
Chemical Identifiers
| CAS Number | 123618-04-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C=O)O.C1=CC=C(C=C1)CO |
Product Overview
Vanillal S 10026 (CAS 123618-04-2), with molecular formula C16H18O4 and molecular weight 274.12 g/mol. IUPAC: 3-ethoxy-4-hydroxybenzaldehyde;phenylmethanol.
Chemical Property Profile of Vanillal S 10026
Property Insights of Vanillal S 10026
The XLogP value of 2.7823 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vanillal S 10026. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Vanillal S 10026. Following Lipinski's Rule of Five, Vanillal S 10026 has 2 hydrogen bond donor(s) and 4 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 Vanillal S 10026?
The CAS number of Vanillal S 10026 is 123618-04-2.
What is the molecular formula of Vanillal S 10026?
The molecular formula of Vanillal S 10026 is C16H18O4.
What is the molecular weight of Vanillal S 10026?
The molecular weight of Vanillal S 10026 is 274.12 g/mol.
Where can I buy Vanillal S 10026?
You can request a quote for Vanillal S 10026 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vanillal S 10026?
Yes, KEHONG BIO provides custom synthesis services for Vanillal S 10026 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.