7-Phenyl heptanoic acid
TL;DR: 7-Phenyl heptanoic acid (CAS 40228-90-8) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-phenylheptanoic acid
Also Known As: 7-Phenylheptanoic acid, Benzeneheptanoic acid, 7-Phenyl-heptanoic acid, phenylheptanoic acid, 7-phenyl heptanoic acid
| Molecular Formula | C13H18O2 |
|---|---|
| Molecular Weight | 206.13 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 206.13068 |
| Heavy Atoms | 15 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 40228-90-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCCCCC(=O)O |
| InChIKey | ZVSXKFNTWOIGJI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Phenyl heptanoic acid (CAS 40228-90-8), with molecular formula C13H18O2 and molecular weight 206.13 g/mol. IUPAC: 7-phenylheptanoic acid.
Chemical Property Profile of 7-Phenyl heptanoic acid
Property Insights of 7-Phenyl heptanoic acid
The XLogP value of 3.6 indicates that 7-Phenyl heptanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 7-Phenyl heptanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Phenyl heptanoic acid 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 7-Phenyl heptanoic acid?
The CAS number of 7-Phenyl heptanoic acid is 40228-90-8.
What is the molecular formula of 7-Phenyl heptanoic acid?
The molecular formula of 7-Phenyl heptanoic acid is C13H18O2.
What is the molecular weight of 7-Phenyl heptanoic acid?
The molecular weight of 7-Phenyl heptanoic acid is 206.13 g/mol.
Where can I buy 7-Phenyl heptanoic acid?
You can request a quote for 7-Phenyl heptanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Phenyl heptanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 7-Phenyl heptanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.