2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride
TL;DR: 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride (CAS 21868-41-7) is a chemical compound with molecular formula C6H6ClN3 and molecular weight 155.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-diazocyclohexa-2,5-dien-1-imine;hydrochloride
Also Known As: p-Diazoiminobenzene hydrochloride, 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride, 4-Diazo-2,5-cyclohexadien-1-imine hydrochloride, 4-diazocyclohexa-2,5-dien-1-imine hydrochloride(1:1), 4-diazocyclohexa-2,5-dien-1-imine hydrochloride
| Molecular Formula | C6H6ClN3 |
|---|---|
| Molecular Weight | 155.03 g/mol |
| LogP | 1.22477 |
| Topological Polar Surface Area | 25.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 155.02502 |
| Heavy Atoms | 10 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 21868-41-7 |
|---|---|
| SMILES | C1=CC(=[N+]=[N-])C=CC1=N.Cl |
| InChIKey | GYZGIFXPLCVZQS-UHFFFAOYSA-N |
Product Overview
2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride (CAS 21868-41-7), with molecular formula C6H6ClN3 and molecular weight 155.03 g/mol. IUPAC: 4-diazocyclohexa-2,5-dien-1-imine;hydrochloride.
Chemical Property Profile of 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride
Property Insights of 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride
The XLogP value of 1.22477 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride. With a topological polar surface area (TPSA) of 25.9 Ų, 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride has 2 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 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride?
The CAS number of 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride is 21868-41-7.
What is the molecular formula of 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride?
The molecular formula of 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride is C6H6ClN3.
What is the molecular weight of 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride?
The molecular weight of 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride is 155.03 g/mol.
Where can I buy 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride?
You can request a quote for 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Cyclohexadien-1-imine, 4-diazo-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.