1-Undecanoylhexamethylenimine
TL;DR: 1-Undecanoylhexamethylenimine (CAS 46996-55-8) is a chemical compound with molecular formula C17H33NO and molecular weight 267.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)undecan-1-one
Also Known As: 1-Undecanoylhexamethylenimine, 1-(azepan-1-yl)undecan-1-one, Hexahydro-1-undecanoyl-1H-azepine, NIOSH/CM3341000, AI3-33515a
| Molecular Formula | C17H33NO |
|---|---|
| Molecular Weight | 267.26 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 267.25623 |
| Heavy Atoms | 19 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 46996-55-8 |
|---|---|
| SMILES | CCCCCCCCCCC(=O)N1CCCCCC1 |
| InChIKey | RIONGNNVXWRVPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Undecanoylhexamethylenimine (CAS 46996-55-8), with molecular formula C17H33NO and molecular weight 267.26 g/mol. IUPAC: 1-(azepan-1-yl)undecan-1-one.
Chemical Property Profile of 1-Undecanoylhexamethylenimine
Property Insights of 1-Undecanoylhexamethylenimine
The XLogP value of 5.5 indicates that 1-Undecanoylhexamethylenimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-Undecanoylhexamethylenimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Undecanoylhexamethylenimine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Undecanoylhexamethylenimine?
The CAS number of 1-Undecanoylhexamethylenimine is 46996-55-8.
What is the molecular formula of 1-Undecanoylhexamethylenimine?
The molecular formula of 1-Undecanoylhexamethylenimine is C17H33NO.
What is the molecular weight of 1-Undecanoylhexamethylenimine?
The molecular weight of 1-Undecanoylhexamethylenimine is 267.26 g/mol.
Where can I buy 1-Undecanoylhexamethylenimine?
You can request a quote for 1-Undecanoylhexamethylenimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Undecanoylhexamethylenimine?
Yes, KEHONG BIO provides custom synthesis services for 1-Undecanoylhexamethylenimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.