Physicochemical Properties
| Molecular Formula | C12H18CL4N4 |
| Molecular Weight | 360.11 |
| Exact Mass | 376.039 |
| CAS # | 868272-85-9 |
| Related CAS # | DAB tetrahydrochloride;7411-49-6;DAB;91-95-2 |
| PubChem CID | 23892 |
| Appearance | Solid |
| Melting Point | 300°C |
| Hydrogen Bond Donor Count | 8 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Heavy Atom Count | 20 |
| Complexity | 209 |
| Defined Atom Stereocenter Count | 0 |
| SMILES | Cl.O.NC1C(N)=CC(C2C=C(N)C(N)=CC=2)=CC=1 |
| InChi Key | KJDSORYAHBAGPP-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C12H14N4.4ClH/c13-9-3-1-7(5-11(9)15)8-2-4-10(14)12(16)6-8;;;;/h1-6H,13-16H2;4*1H |
| Chemical Name | 4-(3,4-diaminophenyl)benzene-1,2-diamine;tetrahydrochloride |
| Synonyms | 3,3'-Diaminobenzidine tetrahydrochloride hydrate; 868272-85-9; [1,1'-Biphenyl]-3,3',4,4'-tetraamine tetrahydrochloride hydrate; 4-(3,4-diaminophenyl)benzene-1,2-diamine;hydrate;tetrahydrochloride; MFCD08273058; DAB; C12H20Cl4N4O; C12H14N4.4HCl; |
| HS Tariff Code | 2934.99.9001 |
| Storage |
Powder-20°C 3 years 4°C 2 years In solvent -80°C 6 months -20°C 1 month |
| Shipping Condition | Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs) |
Biological Activity
| Targets | Biochemical Assay Reagent |
| ln Vitro | A biochemical reagent called DAB 4HCl Hydrate can be utilized in life science research as an organic substance or biological material. |
| Toxicity/Toxicokinetics |
Non-Human Toxicity Values LD50 Mouse ip 330 mg/kg |
| Additional Infomation | 3,3'-diaminobenzidine is a member of the class of biphenyls that is benzidine in which one of the hydrogens ortho to each of the amino groups has been replaced by an amino group. It has a role as a histological dye. It is a member of biphenyls and a substituted aniline. A chemically and thermodynamically stable derivative of BENZIDINE. |
Solubility Data
| Solubility (In Vitro) |
DMSO: 100 mg/mL (277.69 mM) H2O: 50 mg/mL (138.85 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (6.94 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 2.7769 mL | 13.8846 mL | 27.7693 mL | |
| 5 mM | 0.5554 mL | 2.7769 mL | 5.5539 mL | |
| 10 mM | 0.2777 mL | 1.3885 mL | 2.7769 mL |