枯茗醛
TL;DR: 枯茗醛 (CAS 122-03-2) is a chemical compound with molecular formula C10H12O and molecular weight 148.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
枯茗醛
4-propan-2-ylbenzaldehyde
Also Known As: cuminaldehyde, 4-isopropylbenzaldehyde, cumaldehyde, cuminal, cuminic aldehyde
| Molecular Formula | C10H12O |
|---|---|
| Molecular Weight | 148.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 148.08882 |
| Heavy Atoms | 11 |
| Complexity | 121.0 |
| Boiling Point | 235.5 °C |
| Density | 0.973-0.981 |
| Solubility | 282 mg/L @ 20 °C (exp) |
| Refractive Index | 1.527-1.534 |
Chemical Identifiers
| CAS Number | 122-03-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C=O |
| InChIKey | WTWBUQJHJGUZCY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
枯茗醛 (CAS 122-03-2), with molecular formula C10H12O and molecular weight 148.09 g/mol. IUPAC: 4-propan-2-ylbenzaldehyde.
Chemical Property Profile of 枯茗醛
Property Insights of 枯茗醛
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 枯茗醛. With a topological polar surface area (TPSA) of 17.1 Ų, 枯茗醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 枯茗醛 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 枯茗醛?
The CAS number of 枯茗醛 is 122-03-2.
What is the molecular formula of 枯茗醛?
The molecular formula of 枯茗醛 is C10H12O.
What is the molecular weight of 枯茗醛?
The molecular weight of 枯茗醛 is 148.09 g/mol.
Where can I buy 枯茗醛?
You can request a quote for 枯茗醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 枯茗醛?
Yes, KEHONG BIO provides custom synthesis services for 枯茗醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.