2H-氮杂环庚烯
TL;DR: 2H-氮杂环庚烯 (CAS 291-68-9) is a chemical compound with molecular formula C6H7N and molecular weight 93.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2H-氮杂环庚烯
2H-azepine
Also Known As: 2H-azepine, 2H-Isoazepine, RefChem:268441
| Molecular Formula | C6H7N |
|---|---|
| Molecular Weight | 93.06 g/mol |
| LogP | 1.1832 |
| Topological Polar Surface Area | 12.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 93.057846 |
| Heavy Atoms | 7 |
| Complexity | 106.14171 |
Chemical Identifiers
| CAS Number | 291-68-9 |
|---|---|
| SMILES | C1C=CC=CC=N1 |
Product Overview
2H-氮杂环庚烯 (CAS 291-68-9), with molecular formula C6H7N and molecular weight 93.06 g/mol. IUPAC: 2H-azepine.
Chemical Property Profile of 2H-氮杂环庚烯
Property Insights of 2H-氮杂环庚烯
The XLogP value of 1.1832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-氮杂环庚烯. With a topological polar surface area (TPSA) of 12.36 Ų, 2H-氮杂环庚烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-氮杂环庚烯 has 0 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 2H-氮杂环庚烯?
The CAS number of 2H-氮杂环庚烯 is 291-68-9.
What is the molecular formula of 2H-氮杂环庚烯?
The molecular formula of 2H-氮杂环庚烯 is C6H7N.
What is the molecular weight of 2H-氮杂环庚烯?
The molecular weight of 2H-氮杂环庚烯 is 93.06 g/mol.
Where can I buy 2H-氮杂环庚烯?
You can request a quote for 2H-氮杂环庚烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-氮杂环庚烯?
Yes, KEHONG BIO provides custom synthesis services for 2H-氮杂环庚烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.