Fencholic acid
TL;DR: Fencholic acid (CAS 512-77-6) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(1R,3S)-1-methyl-3-propan-2-ylcyclopentane-1-carboxylic acid
Also Known As: Fencholic acid, Cyclopentanecarboxylic acid, cis-, 3-Isopropyl-1-methylcyclopentanecarboxylic acid, (1R,3S)-1-methyl-3-propan-2-ylcyclopentane-1-carboxylic acid, (1r,3s)-1-methyl-3-(propan-2-yl)cyclopentanecarboxylic acid
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 512-77-6 |
|---|---|
| SMILES | CC(C)[C@H]1CC[C@@](C1)(C)C(=O)O |
| InChIKey | IBDVYGIGYPWWBX-WCBMZHEXSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Fencholic acid (CAS 512-77-6), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: trans-(1R,3S)-1-methyl-3-propan-2-ylcyclopentane-1-carboxylic acid.
Chemical Property Profile of Fencholic acid
Property Insights of Fencholic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Fencholic acid. With a topological polar surface area (TPSA) of 37.3 Ų, Fencholic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Fencholic 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 Fencholic acid?
The CAS number of Fencholic acid is 512-77-6.
What is the molecular formula of Fencholic acid?
The molecular formula of Fencholic acid is C10H18O2.
What is the molecular weight of Fencholic acid?
The molecular weight of Fencholic acid is 170.13 g/mol.
Where can I buy Fencholic acid?
You can request a quote for Fencholic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fencholic acid?
Yes, KEHONG BIO provides custom synthesis services for Fencholic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.