Hexahydro-7-(2-propenyl)-1h-azepin-2-one
TL;DR: Hexahydro-7-(2-propenyl)-1h-azepin-2-one (CAS 165385-96-6) is a chemical compound with molecular formula C9H15NO and molecular weight 153.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-prop-2-enylazepan-2-one
Also Known As: 7-allylazepan-2-one, 7-prop-2-enylazepan-2-one, 7-(prop-2-en-1-yl)azepan-2-one, 7-ALLYL-AZEPAN-2-ONE, hexahydro-7-(2-propenyl)-1h-azepin-2-one
| Molecular Formula | C9H15NO |
|---|---|
| Molecular Weight | 153.12 g/mol |
| LogP | 1.6213 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 153.11537 |
| Heavy Atoms | 11 |
| Complexity | 153.64172 |
Chemical Identifiers
| CAS Number | 165385-96-6 |
|---|---|
| SMILES | C=CCC1CCCCC(=O)N1 |
Product Overview
Hexahydro-7-(2-propenyl)-1h-azepin-2-one (CAS 165385-96-6), with molecular formula C9H15NO and molecular weight 153.12 g/mol. IUPAC: 7-prop-2-enylazepan-2-one.
Chemical Property Profile of Hexahydro-7-(2-propenyl)-1h-azepin-2-one
Property Insights of Hexahydro-7-(2-propenyl)-1h-azepin-2-one
The XLogP value of 1.6213 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexahydro-7-(2-propenyl)-1h-azepin-2-one. With a topological polar surface area (TPSA) of 29.1 Ų, Hexahydro-7-(2-propenyl)-1h-azepin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexahydro-7-(2-propenyl)-1h-azepin-2-one has 1 hydrogen bond donor(s) and 1 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-7-(2-propenyl)-1h-azepin-2-one?
The CAS number of Hexahydro-7-(2-propenyl)-1h-azepin-2-one is 165385-96-6.
What is the molecular formula of Hexahydro-7-(2-propenyl)-1h-azepin-2-one?
The molecular formula of Hexahydro-7-(2-propenyl)-1h-azepin-2-one is C9H15NO.
What is the molecular weight of Hexahydro-7-(2-propenyl)-1h-azepin-2-one?
The molecular weight of Hexahydro-7-(2-propenyl)-1h-azepin-2-one is 153.12 g/mol.
Where can I buy Hexahydro-7-(2-propenyl)-1h-azepin-2-one?
You can request a quote for Hexahydro-7-(2-propenyl)-1h-azepin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexahydro-7-(2-propenyl)-1h-azepin-2-one?
Yes, KEHONG BIO provides custom synthesis services for Hexahydro-7-(2-propenyl)-1h-azepin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.