2-Pentenal, 5-phenyl-
TL;DR: 2-Pentenal, 5-phenyl- (CAS 330461-92-2) is a chemical compound with molecular formula C11H12O and molecular weight 160.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenylpent-2-enal
Also Known As: 5-Phenyl-2-pentenal, 2-Pentenal, 5-phenyl-, 5-PHENYLPENT-2-ENAL, 2-(4-fluorophenyl)-5-(pyridin-4-yl)-1,3,4-oxadiazole, RefChem:265024
| Molecular Formula | C11H12O |
|---|---|
| Molecular Weight | 160.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 160.08882 |
| Heavy Atoms | 12 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 330461-92-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC=CC=O |
| InChIKey | DCEMFJJXTBOOAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Pentenal, 5-phenyl- (CAS 330461-92-2), with molecular formula C11H12O and molecular weight 160.09 g/mol. IUPAC: 5-phenylpent-2-enal.
Chemical Property Profile of 2-Pentenal, 5-phenyl-
Property Insights of 2-Pentenal, 5-phenyl-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pentenal, 5-phenyl-. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Pentenal, 5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pentenal, 5-phenyl- 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 2-Pentenal, 5-phenyl-?
The CAS number of 2-Pentenal, 5-phenyl- is 330461-92-2.
What is the molecular formula of 2-Pentenal, 5-phenyl-?
The molecular formula of 2-Pentenal, 5-phenyl- is C11H12O.
What is the molecular weight of 2-Pentenal, 5-phenyl-?
The molecular weight of 2-Pentenal, 5-phenyl- is 160.09 g/mol.
Where can I buy 2-Pentenal, 5-phenyl-?
You can request a quote for 2-Pentenal, 5-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pentenal, 5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pentenal, 5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.