铃兰醛
TL;DR: 铃兰醛 (CAS 75166-31-3) is a chemical compound with molecular formula C14H20O and molecular weight 204.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
铃兰醛
3-(4-tert-butylphenyl)-2-methylpropanal
Also Known As: Lilial, lily aldehyde, Lilestralis, Lilyal, Lilyaldehyde
| Molecular Formula | C14H20O |
|---|---|
| Molecular Weight | 204.15 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 204.15141 |
| Heavy Atoms | 15 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 75166-31-3 |
|---|---|
| SMILES | CC(CC1=CC=C(C=C1)C(C)(C)C)C=O |
| InChIKey | SDQFDHOLCGWZPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
铃兰醛 (CAS 75166-31-3), with molecular formula C14H20O and molecular weight 204.15 g/mol. IUPAC: 3-(4-tert-butylphenyl)-2-methylpropanal.
Chemical Property Profile of 铃兰醛
Property Insights of 铃兰醛
The XLogP value of 3.9 indicates that 铃兰醛 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 铃兰醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 铃兰醛 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 铃兰醛?
The CAS number of 铃兰醛 is 75166-31-3.
What is the molecular formula of 铃兰醛?
The molecular formula of 铃兰醛 is C14H20O.
What is the molecular weight of 铃兰醛?
The molecular weight of 铃兰醛 is 204.15 g/mol.
Where can I buy 铃兰醛?
You can request a quote for 铃兰醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 铃兰醛?
Yes, KEHONG BIO provides custom synthesis services for 铃兰醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.