3,3'-Dichlorobenzidine dihydrochloride
TL;DR: 3,3'-Dichlorobenzidine dihydrochloride (CAS 612-83-9) is a chemical compound with molecular formula C12H12Cl4N2 and molecular weight 323.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-amino-3-chlorophenyl)-2-chloroaniline;dihydrochloride
Also Known As: 3,3'-DICHLOROBENZIDINE DIHYDROCHLORIDE, DICHLODINE H, 3,3'-Dichlorobenzidine 2HCl, 3,3'-Dichlorobenzidine.2HCl, 3,3'-Dichlorobenzidine hydrochloride
| Molecular Formula | C12H12Cl4N2 |
|---|---|
| Molecular Weight | 323.98 g/mol |
| LogP | 4.67 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 325.9725 |
| Heavy Atoms | 18 |
| Complexity | 213.0 |
| Solubility | less than 1 mg/mL at 70.7 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 612-83-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=CC(=C(C=C2)N)Cl)Cl)N.Cl.Cl |
| InChIKey | BXAONUZFBUNTQR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Dichlorobenzidine dihydrochloride (CAS 612-83-9), with molecular formula C12H12Cl4N2 and molecular weight 323.98 g/mol. IUPAC: 4-(4-amino-3-chlorophenyl)-2-chloroaniline;dihydrochloride.
Chemical Property Profile of 3,3'-Dichlorobenzidine dihydrochloride
Property Insights of 3,3'-Dichlorobenzidine dihydrochloride
The XLogP value of 4.67 indicates that 3,3'-Dichlorobenzidine dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.0 Ų, 3,3'-Dichlorobenzidine dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3'-Dichlorobenzidine dihydrochloride has 4 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 3,3'-Dichlorobenzidine dihydrochloride?
The CAS number of 3,3'-Dichlorobenzidine dihydrochloride is 612-83-9.
What is the molecular formula of 3,3'-Dichlorobenzidine dihydrochloride?
The molecular formula of 3,3'-Dichlorobenzidine dihydrochloride is C12H12Cl4N2.
What is the molecular weight of 3,3'-Dichlorobenzidine dihydrochloride?
The molecular weight of 3,3'-Dichlorobenzidine dihydrochloride is 323.98 g/mol.
Where can I buy 3,3'-Dichlorobenzidine dihydrochloride?
You can request a quote for 3,3'-Dichlorobenzidine dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Dichlorobenzidine dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Dichlorobenzidine dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.