Adamantan-2-ylideneacetic acid
TL;DR: Adamantan-2-ylideneacetic acid (CAS 25220-07-9) is a chemical compound with molecular formula C12H16O2 and molecular weight 192.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-adamantylidene)acetic acid
Also Known As: Adamantan-2-ylideneacetic acid, 5-Methylbenzofurazan, 2-(2-adamantylidene)acetic acid, ChemDiv3_000611, adamant-2-ylideneacetic acid
| Molecular Formula | C12H16O2 |
|---|---|
| Molecular Weight | 192.12 g/mol |
| LogP | 2.4535 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.11504 |
| Heavy Atoms | 14 |
| Complexity | 273.4436 |
Chemical Identifiers
| CAS Number | 25220-07-9 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)C3=CC(=O)O |
Product Overview
Adamantan-2-ylideneacetic acid (CAS 25220-07-9), with molecular formula C12H16O2 and molecular weight 192.12 g/mol. IUPAC: 2-(2-adamantylidene)acetic acid.
Chemical Property Profile of Adamantan-2-ylideneacetic acid
Property Insights of Adamantan-2-ylideneacetic acid
The XLogP value of 2.4535 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Adamantan-2-ylideneacetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, Adamantan-2-ylideneacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Adamantan-2-ylideneacetic 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 Adamantan-2-ylideneacetic acid?
The CAS number of Adamantan-2-ylideneacetic acid is 25220-07-9.
What is the molecular formula of Adamantan-2-ylideneacetic acid?
The molecular formula of Adamantan-2-ylideneacetic acid is C12H16O2.
What is the molecular weight of Adamantan-2-ylideneacetic acid?
The molecular weight of Adamantan-2-ylideneacetic acid is 192.12 g/mol.
Where can I buy Adamantan-2-ylideneacetic acid?
You can request a quote for Adamantan-2-ylideneacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adamantan-2-ylideneacetic acid?
Yes, KEHONG BIO provides custom synthesis services for Adamantan-2-ylideneacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.