N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine
TL;DR: N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine (CAS 3136-99-0) is a chemical compound with molecular formula C6H3Cl3N2 and molecular weight 207.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,4-N,2-trichlorocyclohexa-2,5-diene-1,4-diimine
Also Known As: 2,5-Cyclohexadiene-1,4-diimine, N,N',2-trichloro-, p-Benzoquinonediimine, N,N',2-trichloro-, N,N',2-Trichloro-2,5-cyclohexadiene-1,4-diimine, n,n',2-trichlorocyclohexa-2,5-diene-1,4-diimine, N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine
| Molecular Formula | C6H3Cl3N2 |
|---|---|
| Molecular Weight | 207.94 g/mol |
| LogP | 2.8685 |
| Topological Polar Surface Area | 24.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 207.93619 |
| Heavy Atoms | 11 |
| Complexity | 275.55197 |
Chemical Identifiers
| CAS Number | 3136-99-0 |
|---|---|
| SMILES | C\1=C/C(=N\Cl)/C(=C/C1=N/Cl)Cl |
Product Overview
N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine (CAS 3136-99-0), with molecular formula C6H3Cl3N2 and molecular weight 207.94 g/mol. IUPAC: 1-N,4-N,2-trichlorocyclohexa-2,5-diene-1,4-diimine.
Chemical Property Profile of N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine
Property Insights of N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine
The XLogP value of 2.8685 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine. With a topological polar surface area (TPSA) of 24.72 Ų, N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine 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 N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine?
The CAS number of N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine is 3136-99-0.
What is the molecular formula of N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine?
The molecular formula of N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine is C6H3Cl3N2.
What is the molecular weight of N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine?
The molecular weight of N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine is 207.94 g/mol.
Where can I buy N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine?
You can request a quote for N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine?
Yes, KEHONG BIO provides custom synthesis services for N1,N4,2-Trichloro-2,5-cyclohexadiene-1,4-diimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.