Cyclohexanepropanoic acid
TL;DR: Cyclohexanepropanoic acid (CAS 701-97-3) is a chemical compound with molecular formula C9H16O2 and molecular weight 156.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyclohexylpropanoic acid
Also Known As: 3-Cyclohexylpropanoic acid, Cyclohexanepropionic acid, 3-Cyclohexylpropionic acid, Cyclohexanepropanoic acid, 3-Cyclohexanepropionic acid
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 156.11504 |
| Heavy Atoms | 11 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 701-97-3 |
|---|---|
| SMILES | C1CCC(CC1)CCC(=O)O |
| InChIKey | HJZLEGIHUQOJBA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexanepropanoic acid (CAS 701-97-3), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: 3-cyclohexylpropanoic acid.
Chemical Property Profile of Cyclohexanepropanoic acid
Property Insights of Cyclohexanepropanoic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexanepropanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, Cyclohexanepropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanepropanoic 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 Cyclohexanepropanoic acid?
The CAS number of Cyclohexanepropanoic acid is 701-97-3.
What is the molecular formula of Cyclohexanepropanoic acid?
The molecular formula of Cyclohexanepropanoic acid is C9H16O2.
What is the molecular weight of Cyclohexanepropanoic acid?
The molecular weight of Cyclohexanepropanoic acid is 156.12 g/mol.
Where can I buy Cyclohexanepropanoic acid?
You can request a quote for Cyclohexanepropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanepropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanepropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.