![4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid structure](/static/products/4749/474-98-6.webp)
4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid
TL;DR: 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid (CAS 474-98-6) is a chemical compound with molecular formula C11H16O3 and molecular weight 196.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid
Also Known As: Angimuth, Camphocarboxylic acid, Camphercarbonsaure, Bismuth camphocarbonate, d-Camphocarboxylic acid
| Molecular Formula | C11H16O3 |
|---|---|
| Molecular Weight | 196.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.10994 |
| Heavy Atoms | 14 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 474-98-6 |
|---|---|
| SMILES | CC1(C2CCC1(C(=O)C2C(=O)O)C)C |
| InChIKey | XNMVAVGXJZFTEH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid (CAS 474-98-6), with molecular formula C11H16O3 and molecular weight 196.11 g/mol. IUPAC: 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid.
Chemical Property Profile of 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid
Property Insights of 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid. With a topological polar surface area (TPSA) of 54.4 Ų, 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid has 1 hydrogen bond donor(s) and 3 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 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid?
The CAS number of 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid is 474-98-6.
What is the molecular formula of 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid?
The molecular formula of 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid is C11H16O3.
What is the molecular weight of 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid?
The molecular weight of 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid is 196.11 g/mol.
Where can I buy 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid?
You can request a quote for 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,7,7-Trimethyl-3-oxobicyclo[2.2.1]heptane-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.