对异丙基苯乙醛
TL;DR: 对异丙基苯乙醛 (CAS 4395-92-0) is a chemical compound with molecular formula C11H14O and molecular weight 162.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对异丙基苯乙醛
2-(4-propan-2-ylphenyl)acetaldehyde
Also Known As: Cortexal, 4-ISOPROPYLPHENYLACETALDEHYDE, (4-Isopropylphenyl)acetaldehyde, Cumylacetaldehyde, Cuminic acetaldehyde
| Molecular Formula | C11H14O |
|---|---|
| Molecular Weight | 162.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 162.10446 |
| Heavy Atoms | 12 |
| Complexity | 132.0 |
| Boiling Point | 230.00 to 243.00 °C. @ 760.00 mm Hg |
| Density | 0.965-0.975 |
| Solubility | very slightly |
| Refractive Index | 1.515-1.525 |
Chemical Identifiers
| CAS Number | 4395-92-0 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)CC=O |
| InChIKey | FSKGFRBHGXIDSA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
对异丙基苯乙醛 (CAS 4395-92-0), with molecular formula C11H14O and molecular weight 162.10 g/mol. IUPAC: 2-(4-propan-2-ylphenyl)acetaldehyde.
Chemical Property Profile of 对异丙基苯乙醛
Property Insights of 对异丙基苯乙醛
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 对异丙基苯乙醛. With a topological polar surface area (TPSA) of 17.1 Ų, 对异丙基苯乙醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 对异丙基苯乙醛 has 0 hydrogen bond donor(s) and 1 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 对异丙基苯乙醛?
The CAS number of 对异丙基苯乙醛 is 4395-92-0.
What is the molecular formula of 对异丙基苯乙醛?
The molecular formula of 对异丙基苯乙醛 is C11H14O.
What is the molecular weight of 对异丙基苯乙醛?
The molecular weight of 对异丙基苯乙醛 is 162.10 g/mol.
Where can I buy 对异丙基苯乙醛?
You can request a quote for 对异丙基苯乙醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对异丙基苯乙醛?
Yes, KEHONG BIO provides custom synthesis services for 对异丙基苯乙醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.