1-Isopropyl-1H-benzo[d][1,2,3]triazole-5-carbonitrile

Base Information

• Chemical Name: 1-Isopropyl-1H-benzo[d][1,2,3]triazole-5-carbonitrile
• CAS No.: 879558-15-3
• Molecular Formula: C₁₀H₁₀N₄
• Molecular Weight: 186.216
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20468981
• Wikidata: Q82296515
• Mol file: 879558-15-3.mol

Synonyms:879558-15-3;1-Isopropyl-1H-benzo[d][1,2,3]triazole-5-carbonitrile;1-Isopropyl-1,2,3-benzotriazole-5-carbonitrile;1-propan-2-ylbenzotriazole-5-carbonitrile;1-Isopropyl-1H-1,2,3-benzotriazole-5-carbonitrile;1-(Propan-2-yl)-1H-benzotriazole-5-carbonitrile;SCHEMBL19848477;1-(propan-2-yl)-1H-1,2,3-benzotriazole-5-carbonitrile;DTXSID20468981;MFCD09031714;AKOS006290842;CCG-344335;BS-29747;CS-0213034;EN300-6750712

Chemical Property of 1-Isopropyl-1H-benzo[d][1,2,3]triazole-5-carbonitrile

Chemical Property:

• PSA: 54.50000
• LogP: 1.88388
• Storage Temp.: 2-8°C
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 186.090546336
• Heavy Atom Count: 14
• Complexity: 254

Purity/Quality:

98% ^*data from raw suppliers

1-Isopropyl-1,2,3-benzotriazole-5-carbonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)N1C2=C(C=C(C=C2)C#N)N=N1

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