exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid
TL;DR: exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid (CAS 84817-64-1) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanoic acid
Also Known As: EINECS 252-784-0, EINECS 266-507-6, EINECS 284-220-4, 3-(3,3-dimethylnorborn-2-yl)-propionic Acid, exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 2.9235 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 244.70628 |
Chemical Identifiers
| CAS Number | 84817-64-1 |
|---|---|
| SMILES | CC1(C2CCC(C2)C1CCC(=O)O)C |
Product Overview
exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid (CAS 84817-64-1), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: 3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanoic acid.
Chemical Property Profile of exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid
Property Insights of exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid
The XLogP value of 2.9235 suggests moderate lipophilicity, balancing water solubility and membrane permeability for exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid. With a topological polar surface area (TPSA) of 37.3 Ų, exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid has 1 hydrogen bond donor(s) and 1 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 exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid?
The CAS number of exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid is 84817-64-1.
What is the molecular formula of exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid?
The molecular formula of exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid is C12H20O2.
What is the molecular weight of exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid?
The molecular weight of exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid is 196.15 g/mol.
Where can I buy exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid?
You can request a quote for exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for exo-3,3-Dimethylbicyclo(2.2.1)heptane-2-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.