4,4'-亚甲基双(3-氯-2,6-二乙基苯胺)
TL;DR: 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) (CAS 106246-33-7) is a chemical compound with molecular formula C21H28Cl2N2 and molecular weight 378.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4'-亚甲基双(3-氯-2,6-二乙基苯胺)
4-[(4-amino-2-chloro-3,5-diethylphenyl)methyl]-3-chloro-2,6-diethylaniline
Also Known As: 4,4'-Methylenebis(3-chloro-2,6-diethylaniline), M-CDEA, N-ALLYLACRYLAMIDE, Benzenamine, 4,4'-methylenebis[3-chloro-2,6-diethyl-, bis(4-amino-2-chloro-3,5-diethylphenyl)methane
| Molecular Formula | C21H28Cl2N2 |
|---|---|
| Molecular Weight | 378.16 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.16296 |
| Heavy Atoms | 25 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 106246-33-7 |
|---|---|
| SMILES | CCC1=CC(=C(C(=C1N)CC)Cl)CC2=C(C(=C(C(=C2)CC)N)CC)Cl |
| InChIKey | VIOMIGLBMQVNLY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) (CAS 106246-33-7), with molecular formula C21H28Cl2N2 and molecular weight 378.16 g/mol. IUPAC: 4-[(4-amino-2-chloro-3,5-diethylphenyl)methyl]-3-chloro-2,6-diethylaniline.
Chemical Property Profile of 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺)
Property Insights of 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺)
The XLogP value of 6.9 indicates that 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.0 Ų, 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺)?
The CAS number of 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) is 106246-33-7.
What is the molecular formula of 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺)?
The molecular formula of 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) is C21H28Cl2N2.
What is the molecular weight of 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺)?
The molecular weight of 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) is 378.16 g/mol.
Where can I buy 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺)?
You can request a quote for 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-亚甲基双(3-氯-2,6-二乙基苯胺) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.