2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid
TL;DR: 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid (CAS 317375-33-0) is a chemical compound with molecular formula C12H17BrO3 and molecular weight 288.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-2-(3-hydroxy-1-adamantyl)acetic acid
Also Known As: 2-bromo-2-(3-hydroxyadamantan-1-yl)acetic acid, 2-bromo-2-(3-hydroxy-1-adamantyl)acetic Acid, BROMO(3-HYDROXYADAMANTAN-1-YL)ACETIC ACID, alpha-bromo-3-hydroxytricyclo [3.3.1.13,7]decane-1-acetic acid, alpha-bromo-3-hydroxytricyclo[3.3.1.13,7]decane-1-acetic acid
| Molecular Formula | C12H17BrO3 |
|---|---|
| Molecular Weight | 288.04 g/mol |
| LogP | 2.1658 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.0361 |
| Heavy Atoms | 16 |
| Complexity | 327.15558 |
Chemical Identifiers
| CAS Number | 317375-33-0 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)O)C(C(=O)O)Br |
Product Overview
2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid (CAS 317375-33-0), with molecular formula C12H17BrO3 and molecular weight 288.04 g/mol. IUPAC: 2-bromo-2-(3-hydroxy-1-adamantyl)acetic acid.
Chemical Property Profile of 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid
Property Insights of 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid
The XLogP value of 2.1658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid. With a topological polar surface area (TPSA) of 57.53 Ų, 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid 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 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid?
The CAS number of 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid is 317375-33-0.
What is the molecular formula of 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid?
The molecular formula of 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid is C12H17BrO3.
What is the molecular weight of 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid?
The molecular weight of 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid is 288.04 g/mol.
Where can I buy 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid?
You can request a quote for 2-Bromo-2-(3-hydroxyadamantan-1-yl)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-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-2-(3-hydroxyadamantan-1-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.