Hexahydro-alpha-methyl-1H-azepine-1-ethanol
TL;DR: Hexahydro-alpha-methyl-1H-azepine-1-ethanol (CAS 77883-50-2) is a chemical compound with molecular formula C9H19NO and molecular weight 157.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)propan-2-ol
Also Known As: 1-(azepan-1-yl)propan-2-ol, 1- -propanol, 1-Azepan-1-Yl-Propan-2-Ol, Hexahydro-alpha-methyl-1H-azepine-1-ethanol, 1-azaperhydroepinylpropan-2-ol
| Molecular Formula | C9H19NO |
|---|---|
| Molecular Weight | 157.15 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 157.14667 |
| Heavy Atoms | 11 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 77883-50-2 |
|---|---|
| SMILES | CC(CN1CCCCCC1)O |
| InChIKey | RHULHUMGLDCWCP-UHFFFAOYSA-N |
Product Overview
Hexahydro-alpha-methyl-1H-azepine-1-ethanol (CAS 77883-50-2), with molecular formula C9H19NO and molecular weight 157.15 g/mol. IUPAC: 1-(azepan-1-yl)propan-2-ol.
Chemical Property Profile of Hexahydro-alpha-methyl-1H-azepine-1-ethanol
Property Insights of Hexahydro-alpha-methyl-1H-azepine-1-ethanol
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexahydro-alpha-methyl-1H-azepine-1-ethanol. With a topological polar surface area (TPSA) of 23.5 Ų, Hexahydro-alpha-methyl-1H-azepine-1-ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexahydro-alpha-methyl-1H-azepine-1-ethanol 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 Hexahydro-alpha-methyl-1H-azepine-1-ethanol?
The CAS number of Hexahydro-alpha-methyl-1H-azepine-1-ethanol is 77883-50-2.
What is the molecular formula of Hexahydro-alpha-methyl-1H-azepine-1-ethanol?
The molecular formula of Hexahydro-alpha-methyl-1H-azepine-1-ethanol is C9H19NO.
What is the molecular weight of Hexahydro-alpha-methyl-1H-azepine-1-ethanol?
The molecular weight of Hexahydro-alpha-methyl-1H-azepine-1-ethanol is 157.15 g/mol.
Where can I buy Hexahydro-alpha-methyl-1H-azepine-1-ethanol?
You can request a quote for Hexahydro-alpha-methyl-1H-azepine-1-ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexahydro-alpha-methyl-1H-azepine-1-ethanol?
Yes, KEHONG BIO provides custom synthesis services for Hexahydro-alpha-methyl-1H-azepine-1-ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.