hexahydro-1H-pyrrolizin-1-one
TL;DR: hexahydro-1H-pyrrolizin-1-one (CAS 16707-80-5) is a chemical compound with molecular formula C7H11NO and molecular weight 125.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6,7,8-hexahydropyrrolizin-1-one
Also Known As: Hexahydropyrrolizin-1-one, hexahydro-1H-pyrrolizin-1-one, pyrrolizidinone, HEXAHYDRO-PYRROLIZIN-1-ONE, PRASEODYMIUMACETATE
| Molecular Formula | C7H11NO |
|---|---|
| Molecular Weight | 125.08 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 125.08406 |
| Heavy Atoms | 9 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 16707-80-5 |
|---|---|
| SMILES | C1CC2C(=O)CCN2C1 |
| InChIKey | WYOIGGSUICKDNZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
hexahydro-1H-pyrrolizin-1-one (CAS 16707-80-5), with molecular formula C7H11NO and molecular weight 125.08 g/mol. IUPAC: 2,3,5,6,7,8-hexahydropyrrolizin-1-one.
Chemical Property Profile of hexahydro-1H-pyrrolizin-1-one
Property Insights of hexahydro-1H-pyrrolizin-1-one
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for hexahydro-1H-pyrrolizin-1-one. With a topological polar surface area (TPSA) of 20.3 Ų, hexahydro-1H-pyrrolizin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, hexahydro-1H-pyrrolizin-1-one has 0 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-1H-pyrrolizin-1-one?
The CAS number of hexahydro-1H-pyrrolizin-1-one is 16707-80-5.
What is the molecular formula of hexahydro-1H-pyrrolizin-1-one?
The molecular formula of hexahydro-1H-pyrrolizin-1-one is C7H11NO.
What is the molecular weight of hexahydro-1H-pyrrolizin-1-one?
The molecular weight of hexahydro-1H-pyrrolizin-1-one is 125.08 g/mol.
Where can I buy hexahydro-1H-pyrrolizin-1-one?
You can request a quote for hexahydro-1H-pyrrolizin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for hexahydro-1H-pyrrolizin-1-one?
Yes, KEHONG BIO provides custom synthesis services for hexahydro-1H-pyrrolizin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.