(+)-苯己烯酸
TL;DR: (+)-苯己烯酸 (CAS 94886-45-0) is a chemical compound with molecular formula C18H18O2 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(+)-苯己烯酸
2-(4-phenylphenyl)hex-4-enoic acid
Also Known As: Xenyhexenic Acid, Desenovister, Desenovis, Darilin, Acido xenihexenico
| Molecular Formula | C18H18O2 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 266.13068 |
| Heavy Atoms | 20 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 94886-45-0 |
|---|---|
| SMILES | CC=CCC(C1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O |
| InChIKey | ZVRCODPBROUJIT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(+)-苯己烯酸 (CAS 94886-45-0), with molecular formula C18H18O2 and molecular weight 266.13 g/mol. IUPAC: 2-(4-phenylphenyl)hex-4-enoic acid.
Chemical Property Profile of (+)-苯己烯酸
Property Insights of (+)-苯己烯酸
The XLogP value of 4.4 indicates that (+)-苯己烯酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, (+)-苯己烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-苯己烯酸 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 (+)-苯己烯酸?
The CAS number of (+)-苯己烯酸 is 94886-45-0.
What is the molecular formula of (+)-苯己烯酸?
The molecular formula of (+)-苯己烯酸 is C18H18O2.
What is the molecular weight of (+)-苯己烯酸?
The molecular weight of (+)-苯己烯酸 is 266.13 g/mol.
Where can I buy (+)-苯己烯酸?
You can request a quote for (+)-苯己烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-苯己烯酸?
Yes, KEHONG BIO provides custom synthesis services for (+)-苯己烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.