3,5-dibromo-1H-1,2,4-triazole

Base Information

• Chemical Name: 3,5-dibromo-1H-1,2,4-triazole
• CAS No.: 7411-23-6
• Molecular Formula: C2HBr2N3
• Molecular Weight: 226.858
• Hs Code.: 2933990090
• European Community (EC) Number: 691-051-3
• NSC Number: 222386
• DSSTox Substance ID: DTXSID00225059
• Nikkaji Number: J49.163B
• Wikidata: Q72465179
• Mol file: 7411-23-6.mol

Synonyms:3,5-dibromo-1H-1,2,4-triazole;7411-23-6;3,5-Dibromo-1,2,4-triazole;3,5-dibromo-4H-1,2,4-triazole;1H-1,2,4-Triazole, 3,5-dibromo-;s-Triazole, 3,5-dibromo-;3,5-Dibromo-1,2,4-triazole-;C2HBr2N3;NSC 222386;MFCD00487260;Propanoic acid, 3-hydrazinyl;SCHEMBL956728;C2-H-Br2-N3;DTXSID00225059;1H-1,4-Triazole, 3,5-dibromo-;NSC222386;STK114350;AKOS003617928;AKOS015969054;AB06324;CS-W018614;NSC-222386;NCGC00330893-01;3,5-Dibromo-1h-[1,2,4]TRIAZOLE;AC-16394;BP-10002;SY033288;LS-155918;A9517;AM20100717;D5030;FT-0650127;EN300-93953;3,5-Dibromo-1H-1,2,4-triazole, AldrichCPR;O10918;AB01324692-02;11N-725;J-511245;Z57069343

Chemical Property of 3,5-dibromo-1H-1,2,4-triazole

Chemical Property:

• Vapor Pressure: 1.64E-05mmHg at 25°C
• Melting Point: 201 °C
• Refractive Index: 1.667
• Boiling Point: 364.8 °C at 760 mmHg
• PKA: 5.50±0.40(Predicted)
• Flash Point: 174.4 °C
• PSA: 41.57000
• Density: 2.62 g/cm³
• LogP: 1.32970
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 226.85167
• Heavy Atom Count: 7
• Complexity: 68

Purity/Quality:

99.0% ^*data from raw suppliers

3,5-Dibromo-1H-1,2,4-triazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,Xn
• Hazard Codes: Xi,Xn
• Statements: 36/37/38-20/21/22-22
• Safety Statements: 26-36/37/39-22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=NC(=NN1)Br)Br