Mandelaldehyde
TL;DR: Mandelaldehyde (CAS 38673-65-3) is a chemical compound with molecular formula C8H8O2 and molecular weight 136.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2-phenylacetaldehyde
Also Known As: Mandelaldehyde, 2-hydroxy-2-phenylacetaldehyde, hydroxy(phenyl)acetaldehyde, hydroxyphenylacetaldehyde, Phenylhydroxyacetaldehyde
| Molecular Formula | C8H8O2 |
|---|---|
| Molecular Weight | 136.05 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 136.05243 |
| Heavy Atoms | 10 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 38673-65-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C=O)O |
| InChIKey | JCISRQNKHZNVHJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mandelaldehyde (CAS 38673-65-3), with molecular formula C8H8O2 and molecular weight 136.05 g/mol. IUPAC: 2-hydroxy-2-phenylacetaldehyde.
Chemical Property Profile of Mandelaldehyde
Property Insights of Mandelaldehyde
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mandelaldehyde. With a topological polar surface area (TPSA) of 37.3 Ų, Mandelaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mandelaldehyde has 1 hydrogen bond donor(s) and 2 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 Mandelaldehyde?
The CAS number of Mandelaldehyde is 38673-65-3.
What is the molecular formula of Mandelaldehyde?
The molecular formula of Mandelaldehyde is C8H8O2.
What is the molecular weight of Mandelaldehyde?
The molecular weight of Mandelaldehyde is 136.05 g/mol.
Where can I buy Mandelaldehyde?
You can request a quote for Mandelaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mandelaldehyde?
Yes, KEHONG BIO provides custom synthesis services for Mandelaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.