5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one
TL;DR: 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one (CAS 774576-49-7) is a chemical compound with molecular formula C15H22O3 and molecular weight 250.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one
Also Known As: SL-49-2, 6-(benzyloxy)-5-hydroxy-2,2-dimethylhexan-3-one, J2.093.959A, 2,2-Dimethyl-5-hydroxy-6-(benzyloxy)-3-hexanone, 5-hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one
| Molecular Formula | C15H22O3 |
|---|---|
| Molecular Weight | 250.16 g/mol |
| LogP | 2.5694 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 250.15689 |
| Heavy Atoms | 18 |
| Complexity | 365.07513 |
Chemical Identifiers
| CAS Number | 774576-49-7 |
|---|---|
| SMILES | CC(C)(C)C(=O)CC(COCC1=CC=CC=C1)O |
Product Overview
5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one (CAS 774576-49-7), with molecular formula C15H22O3 and molecular weight 250.16 g/mol. IUPAC: 5-hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one.
Chemical Property Profile of 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one
Property Insights of 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one
The XLogP value of 2.5694 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one. With a topological polar surface area (TPSA) of 46.53 Ų, 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one has 1 hydrogen bond donor(s) and 3 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 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one?
The CAS number of 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one is 774576-49-7.
What is the molecular formula of 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one?
The molecular formula of 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one is C15H22O3.
What is the molecular weight of 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one?
The molecular weight of 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one is 250.16 g/mol.
Where can I buy 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one?
You can request a quote for 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Hydroxy-2,2-dimethyl-6-phenylmethoxyhexan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.