![2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid structure](/static/products/6008/6008-44-2.webp)
2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid
TL;DR: 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid (CAS 6008-44-2) is a chemical compound with molecular formula C11H16O2 and molecular weight 180.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid
Also Known As: (3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)acetic acid, 2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid, (2Z)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic ac
| Molecular Formula | C11H16O2 |
|---|---|
| Molecular Weight | 180.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.11504 |
| Heavy Atoms | 13 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 6008-44-2 |
|---|---|
| SMILES | CC1(C2CCC(C2)C1=CC(=O)O)C |
| InChIKey | XXBXCBIFNWCCMR-UHFFFAOYSA-N |
Product Overview
2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid (CAS 6008-44-2), with molecular formula C11H16O2 and molecular weight 180.12 g/mol. IUPAC: 2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid.
Chemical Property Profile of 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid
Property Insights of 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic 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 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid?
The CAS number of 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid is 6008-44-2.
What is the molecular formula of 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid?
The molecular formula of 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid is C11H16O2.
What is the molecular weight of 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid?
The molecular weight of 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid is 180.12 g/mol.
Where can I buy 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid?
You can request a quote for 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,3-Dimethyl-2-bicyclo[2.2.1]heptanylidene)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.