N-乙酰基己内酰胺
TL;DR: N-乙酰基己内酰胺 (CAS 1888-91-1) is a chemical compound with molecular formula C8H13NO2 and molecular weight 155.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-乙酰基己内酰胺
1-acetylazepan-2-one
Also Known As: N-Acetylcaprolactam, 1-Acetylazepan-2-one, Acetylcaprolactam, Acetylkaprolaktam, N-Acetyl-6-caprolactam
| Molecular Formula | C8H13NO2 |
|---|---|
| Molecular Weight | 155.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 155.09464 |
| Heavy Atoms | 11 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 1888-91-1 |
|---|---|
| SMILES | CC(=O)N1CCCCCC1=O |
| InChIKey | QISSLHPKTCLLDL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-乙酰基己内酰胺 (CAS 1888-91-1), with molecular formula C8H13NO2 and molecular weight 155.09 g/mol. IUPAC: 1-acetylazepan-2-one.
Chemical Property Profile of N-乙酰基己内酰胺
Property Insights of N-乙酰基己内酰胺
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-乙酰基己内酰胺. With a topological polar surface area (TPSA) of 37.4 Ų, N-乙酰基己内酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-乙酰基己内酰胺 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 N-乙酰基己内酰胺?
The CAS number of N-乙酰基己内酰胺 is 1888-91-1.
What is the molecular formula of N-乙酰基己内酰胺?
The molecular formula of N-乙酰基己内酰胺 is C8H13NO2.
What is the molecular weight of N-乙酰基己内酰胺?
The molecular weight of N-乙酰基己内酰胺 is 155.09 g/mol.
Where can I buy N-乙酰基己内酰胺?
You can request a quote for N-乙酰基己内酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-乙酰基己内酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-乙酰基己内酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.