Ketone, 1-chloro-3-adamantyl hydroxymethyl
TL;DR: Ketone, 1-chloro-3-adamantyl hydroxymethyl (CAS 73599-90-3) is a chemical compound with molecular formula C12H17ClO2 and molecular weight 228.0917 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-chloro-1-adamantyl)-2-hydroxyethanone
Also Known As: Ethanone, 1-(1-chloro-3-adamantyl)-2-hydroxy-, KETONE, 1-CHLORO-3-ADAMANTYL HYDROXYMETHYL, 1-(3-chloro-1-adamantyl)-2-hydroxyethanone, 1-(3-Chloroadamantan-1-yl)-2-hydroxyethan-1-one, BRN 1877153
Technical Specifications
| Molecular Formula | C12H17ClO2 |
| Molecular Weight | 228.0917 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.0917 Da |
| Heavy Atoms | 15 |
| Complexity | 299.0 |
| SMILES | C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)CO |
| InChIKey | DWOFXJGPHBNHFE-UHFFFAOYSA-N |
Chemical Property Profile of Ketone, 1-chloro-3-adamantyl hydroxymethyl
Property Insights of Ketone, 1-chloro-3-adamantyl hydroxymethyl
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ketone, 1-chloro-3-adamantyl hydroxymethyl. With a topological polar surface area (TPSA) of 37.3 Ų, Ketone, 1-chloro-3-adamantyl hydroxymethyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketone, 1-chloro-3-adamantyl hydroxymethyl 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
What is the CAS number of Ketone, 1-chloro-3-adamantyl hydroxymethyl?
The CAS number of Ketone, 1-chloro-3-adamantyl hydroxymethyl is 73599-90-3.
What is the molecular formula of Ketone, 1-chloro-3-adamantyl hydroxymethyl?
The molecular formula of Ketone, 1-chloro-3-adamantyl hydroxymethyl is C12H17ClO2.
What is the molecular weight of Ketone, 1-chloro-3-adamantyl hydroxymethyl?
The molecular weight of Ketone, 1-chloro-3-adamantyl hydroxymethyl is 228.0917 g/mol.
Where can I buy Ketone, 1-chloro-3-adamantyl hydroxymethyl?
You can request a quote for Ketone, 1-chloro-3-adamantyl hydroxymethyl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ketone, 1-chloro-3-adamantyl hydroxymethyl?
Yes, CoreyChem provides custom synthesis services for Ketone, 1-chloro-3-adamantyl hydroxymethyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.