3,3'-Diaminobenzidine tetrahydrochloride dihydrate

Base Information

• Chemical Name: 3,3'-Diaminobenzidine tetrahydrochloride dihydrate
• CAS No.: 167684-17-5
• Molecular Formula: C12H14 N4 . 4 Cl H . 2 H2 O
• Molecular Weight: 396.14
• European Community (EC) Number: 685-525-9,808-580-4
• UNII: Z3KH58591V
• Wikidata: Q27294950
• Mol file: 167684-17-5.mol

Synonyms:167684-17-5;3,3'-Diaminobenzidine tetrahydrochloride dihydrate;(1,1'-Biphenyl)-3,3',4,4'-tetramine tetrahydrochloride dihydrate;UNII-Z3KH58591V;Z3KH58591V;(1,1'-Biphenyl)-3,3',4,4'-tetramine, tetrahydrochloride, dihydrate;(1,1'-Biphenyl)-3,3',4,4'-tetramine, hydrochloride, hydrate (1:4:2);4-(3,4-diaminophenyl)benzene-1,2-diamine;dihydrate;tetrahydrochloride;3,3' Diaminobenzidine Tetrahydrochloride;[1,1'-Biphenyl]-3,3',4,4'-tetramine, hydrochloride, hydrate (1:4:2);3,3-Diaminobenzidine (tetrahydrochloride dihydrate);DAB;868272-85-9;Cambridge id 5140900;MFCD00150106;AKOS015901768;HY-W288940;AS-10374;CS-0333908;3,3'-DIAMINOBENZIDINE TETRAHCL DIHYDRATE;Q27294950;3,3'-DIAMINOBENZIDINE TETRAHYDROCHLORIDE DIHYDRATE [MI]

Chemical Property of 3,3'-Diaminobenzidine tetrahydrochloride dihydrate

Chemical Property:

• Appearance/Colour: off-white to grey powder
• Melting Point: 280 ºC
• Boiling Point: 481.7oC at 760 mmHg
• Flash Point: 282.7oC
• PSA: 122.54000
• LogP: 7.08660
• Water Solubility.: moderately soluble
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 396.046737
• Heavy Atom Count: 22
• Complexity: 209

Purity/Quality:

≥99.0% ^*data from raw suppliers

3,3''-Diaminobenzidine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36/37/38-40
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1C2=CC(=C(C=C2)N)N)N)N.O.O.Cl.Cl.Cl.Cl
• Recent ClinicalTrials: Study to Evaluate the Effect of SCY-078 on the PK of Dabigatran in Healthy Subjects
• Uses: 3,3''-Diaminobenzidine