2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯
TL;DR: 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯 (CAS 22509-00-8) is a chemical compound with molecular formula C5H8N2O and molecular weight 112.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯
2-oxido-3-aza-2-azoniabicyclo[2.2.1]hept-2-ene
Also Known As: 2,3-Diazabicyclo(2.2.1)hept-2-ene, 2-oxide, 2,3-Diazabicyclo[2.2.1]hept-2-ene,2-oxide, 2,3-diaza-bicyclo[2.2.1]hept-2-ene 2-oxide, 3-oxido-2-aza-3-azoniabicyclo[2.2.1]hept-2-ene, RefChem:244435
| Molecular Formula | C5H8N2O |
|---|---|
| Molecular Weight | 112.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 112.06366 |
| Heavy Atoms | 8 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 22509-00-8 |
|---|---|
| SMILES | C1CC2CC1N=[N+]2[O-] |
| InChIKey | AZTZOKZWCFWCAF-UHFFFAOYSA-N |
Product Overview
2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯 (CAS 22509-00-8), with molecular formula C5H8N2O and molecular weight 112.06 g/mol. IUPAC: 2-oxido-3-aza-2-azoniabicyclo[2.2.1]hept-2-ene.
Chemical Property Profile of 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯
Property Insights of 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯. With a topological polar surface area (TPSA) of 41.1 Ų, 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯 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 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯?
The CAS number of 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯 is 22509-00-8.
What is the molecular formula of 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯?
The molecular formula of 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯 is C5H8N2O.
What is the molecular weight of 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯?
The molecular weight of 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯 is 112.06 g/mol.
Where can I buy 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯?
You can request a quote for 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯?
Yes, KEHONG BIO provides custom synthesis services for 2-氧化-2,3-二氮杂双环(2.2.1)庚-2-烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.