3-Carboxyadamantane-1-acetic acid, 97%
TL;DR: 3-Carboxyadamantane-1-acetic acid, 97% (CAS 56531-58-9) is a chemical compound with molecular formula C13H18O4 and molecular weight 238.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,7S)-3-(carboxymethyl)adamantane-1-carboxylic acid
Also Known As: 3-Carboxyadamantane-1-acetic acid, 5730AE, 3-(carboxymethyl)adamantane-1-carboxylic acid, 3-Carboxyadamantane-1-acetic acid, 97%, J3.244.969G
| Molecular Formula | C13H18O4 |
|---|---|
| Molecular Weight | 238.12 g/mol |
| LogP | 2.1323 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.12051 |
| Heavy Atoms | 17 |
| Complexity | 372.8807 |
Chemical Identifiers
| CAS Number | 56531-58-9 |
|---|---|
| SMILES | C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)C(=O)O)CC(=O)O |
Product Overview
3-Carboxyadamantane-1-acetic acid, 97% (CAS 56531-58-9), with molecular formula C13H18O4 and molecular weight 238.12 g/mol. IUPAC: (5R,7S)-3-(carboxymethyl)adamantane-1-carboxylic acid.
Chemical Property Profile of 3-Carboxyadamantane-1-acetic acid, 97%
Property Insights of 3-Carboxyadamantane-1-acetic acid, 97%
The XLogP value of 2.1323 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Carboxyadamantane-1-acetic acid, 97%. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carboxyadamantane-1-acetic acid, 97%. Following Lipinski's Rule of Five, 3-Carboxyadamantane-1-acetic acid, 97% has 2 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 3-Carboxyadamantane-1-acetic acid, 97%?
The CAS number of 3-Carboxyadamantane-1-acetic acid, 97% is 56531-58-9.
What is the molecular formula of 3-Carboxyadamantane-1-acetic acid, 97%?
The molecular formula of 3-Carboxyadamantane-1-acetic acid, 97% is C13H18O4.
What is the molecular weight of 3-Carboxyadamantane-1-acetic acid, 97%?
The molecular weight of 3-Carboxyadamantane-1-acetic acid, 97% is 238.12 g/mol.
Where can I buy 3-Carboxyadamantane-1-acetic acid, 97%?
You can request a quote for 3-Carboxyadamantane-1-acetic acid, 97% directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Carboxyadamantane-1-acetic acid, 97%?
Yes, KEHONG BIO provides custom synthesis services for 3-Carboxyadamantane-1-acetic acid, 97% and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.