3-Bromoadamantane-1-acetic acid, 97%
TL;DR: 3-Bromoadamantane-1-acetic acid, 97% (CAS 17768-34-2) is a chemical compound with molecular formula C12H17BrO2 and molecular weight 272.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5S,7R)-3-bromo-1-adamantyl]acetic acid
Also Known As: 3-Bromoadamantane-1-acetic acid, 3-Bromo-1-adamantaneacetic acid, (3-bromo-1-adamantyl)acetic acid, 2-(3-bromo-1-adamantyl)acetic Acid, (3-Bromo-adamantan-1-yl)-acetic acid
| Molecular Formula | C12H17BrO2 |
|---|---|
| Molecular Weight | 272.04 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.0412 |
| Heavy Atoms | 15 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 17768-34-2 |
|---|---|
| SMILES | C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Br)CC(=O)O |
| InChIKey | HFGLWCBEPPFDDJ-LRSDLPTKSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Bromoadamantane-1-acetic acid, 97% (CAS 17768-34-2), with molecular formula C12H17BrO2 and molecular weight 272.04 g/mol. IUPAC: 2-[(5S,7R)-3-bromo-1-adamantyl]acetic acid.
Chemical Property Profile of 3-Bromoadamantane-1-acetic acid, 97%
Property Insights of 3-Bromoadamantane-1-acetic acid, 97%
The XLogP value of 3.0 indicates that 3-Bromoadamantane-1-acetic acid, 97% is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3-Bromoadamantane-1-acetic acid, 97% exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromoadamantane-1-acetic acid, 97% 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 3-Bromoadamantane-1-acetic acid, 97%?
The CAS number of 3-Bromoadamantane-1-acetic acid, 97% is 17768-34-2.
What is the molecular formula of 3-Bromoadamantane-1-acetic acid, 97%?
The molecular formula of 3-Bromoadamantane-1-acetic acid, 97% is C12H17BrO2.
What is the molecular weight of 3-Bromoadamantane-1-acetic acid, 97%?
The molecular weight of 3-Bromoadamantane-1-acetic acid, 97% is 272.04 g/mol.
Where can I buy 3-Bromoadamantane-1-acetic acid, 97%?
You can request a quote for 3-Bromoadamantane-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-Bromoadamantane-1-acetic acid, 97%?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromoadamantane-1-acetic acid, 97% and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.